SCHEMBL8327334

SCHEMBL8327334

Cc1cc(Br)cc(C)c1NN

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
RAPGEF4 Q8WZA2 4/20 0.39
ALDH1A1 P00352 3/20 0.38
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
DHFR P00374 1/20 0.33
NQO2 P16083 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
IDO1 P14902 1/20 0.30

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 SCHEMBL8328636 0.97 HTR1D (0.39) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL22453893 0.86 CYP3A4 (0.37) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL18960495 0.81 GABRA1 (0.45) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL3212255 0.78 RAPGEF4 (0.60) RAPGEF4ALDH1A1
SCHEMBL1285327 0.77 CYP3A4 (0.37) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
Hydrochloric Acid SCHEMBL2071013 0.76 RAPGEF4 (0.57) RAPGEF4ALDH1A1
SCHEMBL29021130 0.76 HTR1D (0.41) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL16172587 0.74 HTR1D (0.40) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL25787216 0.74 HTR1D (0.40) HTR1DHTR1BRAPGEF4ALDH1A1TAS1R3
SCHEMBL11982081 0.74 RAPGEF4 (0.36) RAPGEF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4397663-A1 6-AMINOPYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF Japan Tobacco, Inc. (JP) 2024-07-10 EP disclosed
US-20170166599-A1 METAL COMPLEX AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-15 US disclosed
EP-3168223-A1 METAL COMPLEX AND LIGHT EMITTING ELEMENT USING SAME Sumitomo Chemical Company, Limited (JP) 2017-05-17 EP disclosed
US-20160362392-A1 GLUCAGON RECEPTOR MODULATORS PFIZER INC. (US) 2016-12-15 US disclosed
US-20160362392-A1 GLUCAGON RECEPTOR MODULATORS PFIZER INC. (US) 2016-12-15 US disclosed
US-20160362392-A1 GLUCAGON RECEPTOR MODULATORS PFIZER INC. (US) 2016-12-15 US disclosed
US-9452999-B2 Glucagon receptor modulators PFIZER INC. (US) 2016-09-27 US disclosed
US-9452999-B2 Glucagon receptor modulators PFIZER INC. (US) 2016-09-27 US disclosed
US-9452999-B2 Glucagon receptor modulators PFIZER INC. (US) 2016-09-27 US disclosed
EP-2673260-B1 GLUCAGON RECEPTOR MODULATOR PFIZER (US) 2016-08-17 EP disclosed
US-20120202834-A1 GLUCAGON RECEPTOR MODULATORS PFIZER INC. (US) 2012-08-09 US disclosed
US-5968944-A TREATING STRESS AND ANXIETY RELATED DISORDERS PFIZER INC. (US) 1999-10-19 US disclosed
EP-0674625-B1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER (US) 1997-12-10 EP disclosed
CN-1036456-C Amino-substituted pyrazoles 1997-11-19 CN disclosed
US-5668145-A Amino-substituted pyrazoles having CRF antagonistic activity PFIZER INC. (US) 1997-09-16 US disclosed
EP-0764153-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1997-03-26 EP disclosed
WO-1995033727-A1 SUBSTITUTED PYRAZOLES HAVING CORTICOTROPIN-RELEASING FACTOR (CRF) ANTAGONIST ACTIVITY PFIZER INC. (US) 1995-12-14 WO disclosed
EP-0674625-A1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER INC. (US) 1995-10-04 EP disclosed
CN-1094038-A The amino pyrazoles that replaces PFIZER (US) 1994-10-26 CN disclosed
WO-1994013644-A1 AMINO-SUBSTITUTED PYRAZOLES HAVING CRF ANTAGONISTIC ACTIVITY PFIZER INC. (US) 1994-06-23 WO 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 (3 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-20170166599-A1 METAL COMPLEX AND LIGHT EMITTING DEVICE USING THE SAME CRY1, AP2M1, CCNE2 HTR1D 891/4885HTR1B 942/4885RAPGEF4 3549/4885
US-20160362392-A1 GLUCAGON RECEPTOR MODULATORS GLP1R, GCGR, GPR119 HTR1D 782/4885HTR1B 296/4885RAPGEF4 466/4885
US-20120202834-A1 GLUCAGON RECEPTOR MODULATORS GLP1R, GCGR, GPR119 HTR1D 782/4885HTR1B 296/4885RAPGEF4 466/4885

“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.