SCHEMBL277940

SCHEMBL277940

O=C=Nc1ccc(-c2ccc(N=C=O)c(Cl)c2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
MAPK1 P28482 2/20 0.45
AHR P35869 5/20 0.42
TRPA1 O75762 1/20 0.38
TSHR P16473 2/20 0.37
CYP1B1 Q16678 1/20 0.37
ESR2 Q92731 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
KMO O15229 1/20 0.31

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
SCHEMBL29565739 1.00 CYP3A4 (0.53) CYP3A4TDP1ALDH1A1HPGDMAPK1
Methane SCHEMBL11583017 0.98 CYP3A4 (0.52) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL13893502 0.85 CYP3A4 (0.41) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL29862788 0.83 TDP1 (0.45) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL227614 0.83 TDP1 (0.45) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL18961264 0.82 TDP1 (0.46) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL462305 0.81 TDP1 (0.70) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL29709073 0.81 TDP1 (0.70) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL1891516 0.79 CYP3A4 (0.59) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL1021615 0.79 TDP1 (0.42) CYP3A4TDP1ALDH1A1HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11498926-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE CORPORATION (US) 2022-11-15 US claimed
US-11427684-B2 Photopatterned planarization layers for flexible electronics ARES Materials, Inc. (US) 2022-08-30 US claimed
US-20210188872-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORTION 2021-06-24 US claimed
US-20210147631-A1 PHOTOPATTERNED PLANARIZATION LAYERS FOR FLEXIBLE ELECTRONICS ARES Materials, Inc. 2021-05-20 US claimed
EP-3781221-A1 ZWITTERIONIC POLYMERS FOR BIOMEDICAL APPLICATIONS The Board of Trustees of the University of Illinois (US) 2021-02-24 EP claimed
US-20200255709-A1 OPTICALLY CLEAR ADHESIVES USING SEMI-INTERPENETRATING POLYMER NETWORKS ARES Materials, Inc. 2020-08-13 US claimed
US-20200123410-A1 METHOD FOR FORMING FLEXIBLE COVER LENS FILMS ARES MATERIALS INC. 2020-04-23 US claimed
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE HOLDINGS CORPORATION (US) 2019-11-05 US claimed
WO-2019204712-A1 ZWITTERIONIC POLYMERS FOR BIOMEDICAL APPLICATIONS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-10-24 WO claimed
EP-2970282-B1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE HOLDINGS CORP (US) 2019-08-21 EP claimed
US-5426204-A Trialkoxysilane with urea, urethane, sulfide or amide linkages CIBA-GEIGY CORPORATION (US) 1995-06-20 US claimed
EP-0406161-B1 Fluorine and/or silicone containing poly(alkylene-oxide)-block copolymers and contact lenses thereof CIBA GEIGY AG (CH) 1995-02-22 EP claimed
US-5372889-A Glass coating with improved adhesion and weather resistance CIBA-GEIGY CORPORATION (US) 1994-12-13 US claimed
EP-0455585-B1 Unsaturated urea polysiloxanes CIBA GEIGY AG (CH) 1994-03-23 EP claimed
US-5266715-A Covalent bonding of a siloxane-urea compound to form crosslinked copolymer CIBA-GEIGY CORPORATION (US) 1993-11-30 US claimed
US-5200493-A Polyurethanes and polythiourethanes; protective coatings; oil repellents; waterproofing; antisoilants CIBA-GEIGY CORPORATION (US) 1993-04-06 US claimed
EP-0455585-A1 Unsaturated urea polysiloxanes CIBA-GEIGY AG (CH) 1991-11-06 EP claimed
EP-0406161-A2 Fluorine and/or silicone containing poly(alkylene-oxide)-block copolymers and contact lenses thereof CIBA-GEIGY AG (CH) 1991-01-02 EP claimed
US-4342860-A AN UNSATUREATED IMIDE IS USED WITH A DI OR POLYISOCYANATE TO FORM A POLYIMIDE POLYMER RHONE-POULENC INDUSTRIES (FR) 1982-08-03 US claimed
US-4342861-A AN UNSATURATGED IMIDE AND A DI OR POLYISOCYANATE GO TO MAKE UP A POLYIMIDE POLYMER WHICH ALSO CONTAINS REPEATING AMIDE GROUPS RHONE-POULENC INDUSTRIES (FR) 1982-08-03 US claimed

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-20210188872-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 CYP3A4 3151/4885TDP1 1389/4885ALDH1A1 4459/4885
US-11498926-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 CYP3A4 3151/4885TDP1 1389/4885ALDH1A1 4459/4885
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 CYP3A4 3151/4885TDP1 1389/4885ALDH1A1 4459/4885

“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.