SCHEMBL8923280

SCHEMBL8923280

C=C(C)OC(=O)c1ccccc1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 7/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALDH1A1 P00352 4/20 0.43
GAA P10253 2/20 0.43
USP2 O75604 1/20 0.43
MIF P14174 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL22880637 0.87 CASP3 (0.46) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL11765420 0.86 TSHR (0.50) L3MBTL1HPGDLMNACYP1A2ALDH1A1
SCHEMBL5484453 0.86 KMT2A (0.49) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL25167793 0.80 KMT2A (0.49) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL29220302 0.78 ALDH1A1 (0.56) MAPTHPGDLMNACYP1A2ALDH1A1
SCHEMBL11586441 0.78 NPC1 (0.47) CASP3SENP8SENP7SENP6KMT2A
SCHEMBL27852725 0.78 KMT2A (0.41) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL23659 0.78 TSHR (0.61) KMT2AMAPTHPGDLMNACYP1A2
SCHEMBL6963405 0.78 KMT2A (0.46) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL29433258 0.78 TSHR (0.61) KMT2AMAPTHPGDLMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855221-B2 Crystalline form of an alkoxyimidazol-1-ylmethyl biphenyl carboxylic acid THERAVANCE, INC. (US) 2010-12-21 US disclosed
US-20100081697-A1 CRYSTALLINE FORM OF AN ALKOXYIMIDAZOL-1-YLMETHYL BIPHENYL CARBOXYLIC ACID THERAVANCE BIOPHARMA R&D IP, LLC 2010-04-01 US disclosed
US-5627240-A PAINT BINDER, N-ACRYLOYLCARBAMATE POLYMER, LACTONE-MODIFIED LOWER POLYHYDRIC ALCOHOL NIPPON PAINT CO., LTD. (JP) 1997-05-06 US disclosed
EP-0243160-B2 Blocked isocyanatocarbonyl group-containing polymers NIPPON PAINT CO LTD (JP) 1996-11-13 EP disclosed
EP-0207621-B1 Functional polymers and their production NIPPON PAINT CO LTD (JP) 1995-04-05 EP disclosed
EP-0630921-A2 Functional polymers and their production NIPPON PAINT CO., LTD. (JP) 1994-12-28 EP disclosed
US-5274062-A An N-(substituted oxalyl)-halopropionamide NIPPON PAINT CO., LTD. (JP) 1993-12-28 US disclosed
US-5208308-A N-Oxalyl-Substituted NIPPON PAINT CO., LTD. (JP) 1993-05-04 US disclosed
EP-0206544-B1 INSTANTANEOUSLY CURABLE COMPOSITION Nippon Paint Co., Ltd. (JP) 1992-01-08 EP disclosed
US-4970281-A COATINGS, ADHESIVES, MOLDING NIPPON PAINT CO., LTD. (JP) 1990-11-13 US disclosed
US-4035275-A ELECTRODEPOSITION, CATIONIC EPOXY RESINS PPG INDUSTRIES, INC. (US) 1977-07-12 US disclosed
US-4031290-A ALPHA-BETA MONOMERS, CATALYSIS PPG INDUSTRIES, INC. (US) 1977-06-21 US disclosed
US-4016332-A OF ETHYLENICALLY UNSATURATED MONOMERS PPG INDUSTRIES, INC. (US) 1977-04-05 US disclosed
US-4001156-A Method of producing epoxy group-containing, quaternary ammonium salt-containing resins PPG INDUSTRIES, INC. (US) 1977-01-04 US disclosed
US-3975346-A ELECTRO-DEPOSITION PPG INDUSTRIES, INC. (US) 1976-08-17 US disclosed
US-3959106-A EPOXY COMPOUNDS; SULFIDES PPG INDUSTRIES, INC. (US) 1976-05-25 US disclosed
US-3939051-A Process for electrodeposition of cationic thermosetting compositions PPG INDUSTRIES, INC. (US) 1976-02-17 US disclosed
US-3937679-A COATINGS, AMMONIUM, SULFONIUM, OR PHOSPHONIUM ACID SALT, AMINE-ALDEHYDE CONDENSATE, AND A METHYOL PHENOL ETHER PPG INDUSTRIES, INC. (US) 1976-02-10 US disclosed
US-3936405-A CATIONIC POLYMER PPG INDUSTRIES, INC. (US) 1976-02-03 US disclosed
US-3933940-A Mercaptan blocked thermosetting copolymers PPG INDUSTRIES, INC. (US) 1976-01-20 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 (1 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-20100081697-A1 CRYSTALLINE FORM OF AN ALKOXYIMIDAZOL-1-YLMETHYL BIPHENYL CARBOXYLIC ACID FFAR1, FFAR3, FFAR2 CASP3 941/4885SENP8 938/4885SENP7 3536/4885

“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.