SCHEMBL8299745

SCHEMBL8299745

COC(=O)c1ccc(Cc2ccc(Cl)cc2C(=O)NCc2ccc3c(c2)OCO3)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TSHR P16473 2/20 0.57
PKM P14618 1/20 0.56
TDP1 Q9NUW8 1/20 0.54
POLB P06746 3/20 0.54
KDM4E B2RXH2 2/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
MAPT P10636 1/20 0.54
ALOX12 P18054 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
HSD17B10 Q99714 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53

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
SCHEMBL8293174 0.87 TSHR (0.56) HPGDMEN1KMT2ATSHRPKM
SCHEMBL8301382 0.80 MCHR1 (0.63) HPGDMEN1KMT2ATSHRPKM
SCHEMBL8212431 0.78 TDP1 (0.54) HPGDMEN1KMT2ATSHRPKM
SCHEMBL6941709 0.78 HPGD (0.64) HPGDMEN1KMT2ATSHRPKM
SCHEMBL5334385 0.77 PKM (0.69) HPGDMEN1KMT2ATSHRPKM
SCHEMBL5334387 0.77 PKM (0.69) HPGDMEN1KMT2ATSHRPKM
Hydrochloric Acid SCHEMBL8300980 0.77 HPGD (0.63) HPGDMEN1KMT2ATSHRPKM
SCHEMBL8293093 0.76 HPGD (0.59) HPGDMEN1KMT2ATSHRPKM
SCHEMBL17242693 0.76 MEN1 (0.64) HPGDMEN1KMT2ATSHRPKM
SCHEMBL8291718 0.75 MEN1 (0.58) HPGDMEN1KMT2ATSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
US-5716993-A PHOSPHODIESTERASE ENZYME INHIBITOR FOR TREATING CARDIOVASCULAR DISORDER, ANGINA PECTORIS, HYPERTENSION, ASTHMA EISAI CO., LTD. (JP) 1998-02-10 US disclosed
CN-1118595-A Anthranilic acid derivative EISAI CO LTD (JP) 1996-03-13 CN disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed