SCHEMBL714973

SCHEMBL714973

COc1ccc(CCN)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.70
ATM Q13315 1/20 0.70
TSHR P16473 2/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
NFKB1 P19838 1/20 0.64
GLA P06280 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
LMNA P02545 2/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
APEX1 P27695 1/20 0.62
TAAR1 Q96RJ0 5/20 0.61
MAPK1 P28482 1/20 0.61
PNMT P11086 1/20 0.60
ALDH1A1 P00352 1/20 0.53
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
CYP19A1 P11511 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL1467248 0.98 KDM4E (0.68) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL6348746 0.89 KDM4E (0.56) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL793618 0.85 KDM4E (0.70) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL30709076 0.85 KDM4E (0.70) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL506373 0.85 CSNK2A1 (0.66) KDM4EATMGLASMN1; SMN2MEN1
SCHEMBL8060167 0.83 MEN1 (0.54) KDM4EATMCYP1A2CYP3A4GLA
Hydrochloric Acid SCHEMBL856874 0.83 CSNK2A1 (0.67) KDM4EATMGLASMN1; SMN2LMNA
SCHEMBL210639 0.82 ATM (1.00) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL29351641 0.82 ATM (1.00) KDM4EATMTSHRCYP1A2CYP3A4
SCHEMBL1042522 0.81 KMT2A (0.57) KDM4EATMTSHRCYP1A2CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210130349-A1 NOVEL PHOSPHODIESTERASE INHIBITORS AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2021-05-06 US disclosed
EP-3483149-B1 BENZO[D]THIAZOLE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME YUHAN CORP (KR) 2021-01-13 EP disclosed
US-10626113-B2 Phosphodiesterase inhibitors and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-04-21 US disclosed
US-10568320-B2 Biologically-based control methods for insect pests THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2020-02-25 US disclosed
US-10568320-B2 Biologically-based control methods for insect pests THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2020-02-25 US disclosed
EP-3022205-B1 NOVEL PHOSPHODIESTERASE INHIBITORS AND USES THEREOF UNIV COLUMBIA (US) 2020-02-05 EP disclosed
US-10383859-B2 Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same YUHAN CORPORATION (KR) 2019-08-20 US disclosed
US-20190142809-A1 Benzo[D]Thiazole Derivative Or Salt Thereof, And Pharmaceutical Composition Including Same YUHAN CORPORATION (KR) 2019-05-16 US disclosed
EP-3483149-A1 BENZO[D]THIAZOLE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME Yuhan Corporation (KR) 2019-05-15 EP disclosed
WO-2018160802-A1 BIOLOGICALLY-BASED CONTROL METHODS FOR INSECT PESTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2018-09-07 WO disclosed
WO-1993013073-A1 SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed
US-5130117-A Imaging agents; monitor effectiveness of drugs in nervous and mental disorders TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1992-07-14 US disclosed
US-5068326-A Agents for imaging human brains, 8-chloro-2,3,4,5-tetrahydro-3 -methyl-5-(4'-(125I)iodophenyl)-1H-3-benzazepine NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 1991-11-26 US disclosed
EP-0391554-A1 Dopamine receptor ligands and imaging agents THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1990-10-10 EP disclosed
US-4477378-A ANTIDEPRESSANTS, NEUROLEPTIC AGENTS SCHERING CORP. (US) 1984-10-16 US disclosed
US-4349472-A NEUROLEPTIC, ANTIDEPRESSANTS, SEDATIVES SCHERING CORPORATION (US) 1982-09-14 US disclosed
US-4284555-A NEUROLEPTIC, ANTIDEPRESSANT, SEDATIVE SCHERING CORPORATION (US) 1981-08-18 US disclosed
EP-0005300-A1 Substituted 8-hydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepines, process for the preparation thereof, and pharmaceutical compositions containing them Technobiotic Ltd. (CH) 1979-11-14 EP disclosed
EP-0005299-A1 Substituted 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepines, process for the preparation thereof, and pharmaceutical compositions containing them Technobiotic Ltd. (CH) 1979-11-14 EP disclosed
EP-0005298-A1 Esters of substituted 8-hydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepines, process for the preparation thereof, and pharmaceutical compositions containing them Technobiotic Ltd. (CH) 1979-11-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10568320-B2 Biologically-based control methods for insect pests PNMT, GAP43, PTMS KDM4E 2397/4885ATM 4159/4885TSHR 262/4885
US-20190142809-A1 Benzo[D]Thiazole Derivative Or Salt Thereof, And Pharmaceutical Composition Including Same ILK, SBDS, BDKRB1 KDM4E 1180/4885ATM 3741/4885TSHR 991/4885
US-10383859-B2 Benzo[d]thiazole derivative or salt thereof, and pharmaceutical composition including same ILK, SBDS, BDKRB1 KDM4E 1180/4885ATM 3741/4885TSHR 991/4885
US-10626113-B2 Phosphodiesterase inhibitors and uses thereof PDE5A, PDE2A, PDE3A KDM4E 328/4885ATM 2896/4885TSHR 4264/4885
US-20210130349-A1 NOVEL PHOSPHODIESTERASE INHIBITORS AND USES THEREOF PDE5A, PDE2A, PDE3A KDM4E 426/4885ATM 2932/4885TSHR 4112/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.