SCHEMBL7730596

SCHEMBL7730596

COc1ccc(C=CC(=O)O)c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.66
CTSL P07711 2/20 0.66
CTSB P07858 2/20 0.66
ABCB1 P08183 1/20 0.66
MAPT P10636 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 3/20 0.64
HPGD P15428 2/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
BACE1 P56817 1/20 0.57
KDM4E B2RXH2 4/20 0.56
NFE2L2 Q16236 3/20 0.53
KEAP1 Q14145 2/20 0.53
GAA P10253 1/20 0.52
ALDH1A1 P00352 2/20 0.52
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TFEB P19484 1/20 0.50

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
SCHEMBL7730591 1.00 CAPN1 (0.66) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL11700315 0.89 CAPN1 (0.68) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL11700309 0.89 CAPN1 (0.68) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL26444782 0.88 CAPN1 (0.63) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL11509282 0.86 CAPN1 (0.64) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL11509280 0.86 CAPN1 (0.64) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL15802506 0.86 CAPN1 (0.64) CAPN1CTSLCTSBABCB1MAPT
SCHEMBL8726893 0.84 NFKB1 (0.61) CAPN1CTSLCTSBMAPTSMN1; SMN2
SCHEMBL6852509 0.84 NFKB1 (0.61) CAPN1CTSLCTSBMAPTSMN1; SMN2
SCHEMBL14947408 0.82 CAPN1 (0.67) CAPN1CTSLCTSBABCB1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3802122-B1 METHOD OF MAKING AN ANTIMICROBIAL MULTILAYER FILM CRYOVAC LLC (US) 2023-08-16 EP disclosed
US-11325357-B2 Method of making an antimicrobial multilayer film CRYOVAC, LLC (US) 2022-05-10 US disclosed
US-20210213713-A1 METHOD OF MAKING AN ANTIMICROBIAL MULTILAYER FILM CRYOVAC, LLC 2021-07-15 US disclosed
EP-0628311-B1 Xanthine-Derivatives as Antidepressants KYOWA HAKKO KOGYO KK (JP) 2002-04-24 EP disclosed
EP-0565377-B1 Therapeutic agents for use in the treatment of Parkinson's Disease KYOWA HAKKO KOGYO KK (JP) 1998-01-07 EP disclosed
US-5587378-A ADMINISTERING A SUBSTITUTED XANTHINE COMPOUND KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-12-24 US disclosed
US-5543415-A ADMINISTERING A XANTHINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-08-06 US disclosed
US-5484920-A XANTHINE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-01-16 US disclosed
EP-0628311-A1 ANTIDEPRESSANT KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-12-14 EP disclosed
EP-0565377-A1 Therapeutic agents for use in the treatment of parkinson's disease KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-10-13 EP disclosed
US-3985896-A Benzophenalenofurans SMITHKLINE CORPORATION (US) 1976-10-12 US disclosed