SCHEMBL4167977

SCHEMBL4167977

OCCCCNc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.70
MAPT P10636 3/20 0.70
KCNH3 Q9ULD8 5/20 0.61
KDM4E B2RXH2 2/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 1/20 0.47
RAD52 P43351 1/20 0.47
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
PDE5A O76074 1/20 0.45
RECQL P46063 1/20 0.44
MCL1 Q07820 1/20 0.44
PRSS1 P07477 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL28270197 1.00 ALDH1A1 (0.70) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL6931598 0.98 ALDH1A1 (0.67) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL10775174 0.98 ALDH1A1 (0.67) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL16297292 0.98 ALDH1A1 (0.67) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL9810066 0.98 ALDH1A1 (0.67) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL26906 0.93 ALDH1A1 (0.73) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL7776469 0.91 ALDH1A1 (0.70) ALDH1A1MAPTKCNH3KDM4EGAA
Hydrochloric Acid SCHEMBL16987 0.91 ALDH1A1 (0.70) ALDH1A1MAPTKCNH3KDM4EGAA
SCHEMBL27928250 0.91 ALDH1A1 (0.70) ALDH1A1MAPTKCNH3KDM4EGAA
Ammonia Solution, Strong SCHEMBL27928249 0.91 ALDH1A1 (0.70) ALDH1A1MAPTKCNH3KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109172825-A A kind of pH and the double response type nano containers of redox and preparation method thereof 南京理工大学 2019-01-11 CN claimed
CN-109776618-B Metal complex and preparation method and application thereof 池州学院 2021-11-19 CN disclosed
CN-109172825-A A kind of pH and the double response type nano containers of redox and preparation method thereof 南京理工大学 2019-01-11 CN disclosed
US-9745332-B2 Catalysts and processes for the hydrogenation of amides THE GOVERNORS OF THE UNIVERITY OF ALBERTA (CA) 2017-08-29 US disclosed
US-9745332-B2 Catalysts and processes for the hydrogenation of amides THE GOVERNORS OF THE UNIVERITY OF ALBERTA (CA) 2017-08-29 US disclosed
US-9745332-B2 Catalysts and processes for the hydrogenation of amides THE GOVERNORS OF THE UNIVERITY OF ALBERTA (CA) 2017-08-29 US disclosed
US-20160362372-A1 PRO-NEUROGENIC COMPOUNDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2016-12-15 US disclosed
US-9446042-B2 Pro-neurogenic compounds BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-09-20 US disclosed
US-9162980-B2 Anti-depression compounds BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-10-20 US disclosed
US-20150290195-A1 PRO-NEUROGENIC COMPOUNDS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-10-15 US disclosed
EP-0919554-A1 IMIDAZOLE-SUBSTITUTED QUINOXALINEDIONE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1999-06-02 EP disclosed
US-5518844-A Method of processing a photosensitive material and photosensitive material processor FUJI PHOTO FILM CO., LTD. (JP) 1996-05-21 US disclosed
US-5457105-A anticancer use; e.g. 4-(3'-chloro-4'-fluoroanilino)-6,7-dimethoxyquinazoline (gefitinib) ZENECA LIMITED (GB) 1995-10-10 US disclosed
EP-0566226-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1993-10-20 EP disclosed
US-5176987-A N-/Hydroxyalkyl/-P-Phenylenediamine Developer FUJI PHOTO FILM CO., LTD. (JP) 1993-01-05 US disclosed
US-5166344-A Process for the preparation of imidazoquinoxalinones BERLEX LABORATORIES, INC. (US) 1992-11-24 US disclosed
US-5055465-A IMIDAZOQUINOXALINONES, THEIR AZA ANALOGS AND PROCESS FOR THEIR PREPARATION BERLEX LABORATORIES, INC. (US) 1991-10-08 US disclosed
EP-0400583-A1 Imidazoquinoxalinones, their aza analogs and process for their preparation BERLEX LABORATORIES, INC. (US) 1990-12-05 EP disclosed
EP-0188846-B1 CRYSTALLINE UNSATURATED POLYESTER AND THE PREPARATION THEREOF DSM RESINS B.V. (NL) 1989-07-26 EP disclosed
US-4839438-A POLYESTERURETHANE COPOLYMERS DSM RESINS B.V. (NL) 1989-06-13 US 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 (2 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-20150290195-A1 PRO-NEUROGENIC COMPOUNDS DCX, GAP43, BDNF ALDH1A1 1654/4885MAPT 559/4885KCNH3 1589/4885
US-20160362372-A1 PRO-NEUROGENIC COMPOUNDS DCX, GAP43, BDNF ALDH1A1 1654/4885MAPT 559/4885KCNH3 1589/4885

“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.