SCHEMBL175541

SCHEMBL175541

O=C(O)Cc1ccccc1-c1ccc(CBr)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.50
ABCC4 O15439 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.50
PTGER1 P34995 2/20 0.48
PTGER4 P35408 2/20 0.48
PTGER3 P43115 2/20 0.48
PTGER2 P43116 2/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
AKR1B1 P15121 2/20 0.47
FFAR1 O14842 3/20 0.45
FFAR4 Q5NUL3 3/20 0.45
KMT2A Q03164 1/20 0.45
PTGS2 P35354 1/20 0.45
ENPP2 Q13822 1/20 0.44
LPAR1 Q92633 2/20 0.44
RXRA P19793 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
SCHEMBL28408449 0.88 PTGS1 (0.66) PTGS1ABCC4LMNAGAATSHR
SCHEMBL5961842 0.84 PTGS1 (0.59) PTGS1ABCC4LMNAGAATSHR
SCHEMBL538512 0.84 KMT2A (0.60) PTGS1ABCC4LMNAGAATSHR
SCHEMBL2391613 0.83 FFAR1 (0.53) PTGS1ABCC4LMNAGAATSHR
SCHEMBL29512995 0.82 KMT2A (0.58) PTGS1ABCC4LMNAGAATSHR
SCHEMBL28594606 0.82 KMT2A (0.58) PTGS1ABCC4LMNAGAATSHR
SCHEMBL27701716 0.82 KMT2A (0.58) PTGS1ABCC4LMNAGAATSHR
Hydrochloric Acid SCHEMBL11895689 0.82 KMT2A (0.58) PTGS1ABCC4LMNAGAATSHR
Ammonia Solution, Strong SCHEMBL27926479 0.82 KMT2A (0.58) PTGS1ABCC4LMNAGAATSHR
SCHEMBL8645744 0.82 PTGS1 (0.55) PTGS1ABCC4LMNAGAATSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103382154-B Synthetic method of methyl 4'-bromomethylbiphenyl-2-carboxylate SHANDONG JINCHENG PHARMACEUTICAL & CHEMICAL CO LTD 2015-01-21 CN claimed
CN-103382154-A Synthetic method of methyl 4'-bromomethylbiphenyl-2-carboxylate SHANDONG JINCHENG PHARMACEUTICAL & CHEMICAL CO LTD 2013-11-06 CN claimed
CN-103382154-B Synthetic method of methyl 4'-bromomethylbiphenyl-2-carboxylate SHANDONG JINCHENG PHARMACEUTICAL & CHEMICAL CO LTD 2015-01-21 CN disclosed
CN-103382154-A Synthetic method of methyl 4'-bromomethylbiphenyl-2-carboxylate SHANDONG JINCHENG PHARMACEUTICAL & CHEMICAL CO LTD 2013-11-06 CN disclosed
WO-2012028925-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF TELMISARTAN OGENE SYSTEMS (I) PVT LTD (IN) 2012-03-08 WO disclosed
US-5274104-A N-substituted heterocyclic derivatives useful in the treatment of cardiovascular disorders ELF SANOFI, A FRENCH CORP. (FR) 1993-12-28 US disclosed