SCHEMBL11187635

SCHEMBL11187635

CCOC(=O)CNCc1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPID Q08752 4/20 0.54
PPIB P23284 1/20 0.54
PPIA P62937 1/20 0.54
PPIG Q13427 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.50
LTA4H P09960 4/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 2/20 0.45
CHRM2 P08172 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL8252663 0.90 SMN1; SMN2 (0.54) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL3176370 0.87 LMNA (0.51) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL21391612 0.87 PPID (0.71) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL14477029 0.87 PPID (0.51) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL13274881 0.87 PPID (0.51) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL8003720 0.87 MAPT (0.59) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL15692215 0.87 KMT2A (0.61) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL75205 0.86 PPID (0.69) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL6811685 0.86 KMT2A (0.50) SMN1; SMN2KMT2AALDH1A1HPGDLMNA
SCHEMBL1251880 0.85 KDM4E (0.53) PPIDPPIBPPIAPPIGSMN1; SMN2

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
US-RE49700-E1 Substituted nitrogen containing compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-17 US disclosed
EP-3210982-A1 MODULATORS OF TOLL-LIKE RECEPTORS Gilead Sciences, Inc. (US) 2017-08-30 EP disclosed
EP-2818469-B1 Intermediates for the preparation of modulators of toll-like receptors GILEAD SCIENCES INC (US) 2017-02-15 EP disclosed
US-7692014-B2 Inhibitors of the HIV integrase enzyme PFIZER, INC. (US) 2010-04-06 US disclosed
US-4421693-A INSECTICIDES, MITICIDES OR NEMATOCIDES OTSUKA CHEMICAL CO., LTD. (JP) 1983-12-20 US disclosed
US-4413005-A 2,3-DIHYDRO-2,2-DIMETHYLBENZOFURAN-7-YL DERIVATIVES OTSUKA KAGAKU YAKUHIN KABUSHIKI KAISHA (JP) 1983-11-01 US disclosed