SCHEMBL2883390

SCHEMBL2883390

Cc1c(S)cccc1-c1ccncc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.41
PARP10 Q53GL7 1/20 0.39
PARP11 Q9NR21 1/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
LRRK2 Q5S007 1/20 0.38
NOTUM Q6P988 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK10 P53779 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
JAK2 O60674 1/20 0.37
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
EPHX1 P07099 1/20 0.35

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
SCHEMBL25628028 0.83 NOTUM (0.50) PIK3CDMAPTLMNANOTUMALDH1A1
SCHEMBL1130074 0.79 CYP2A6 (0.49) PARP10PARP11MAPTLMNAALDH1A1
SCHEMBL21742828 0.79 NOTUM (0.58) PIK3CDMAPTLMNANOTUMALDH1A1
SCHEMBL7266829 0.79 PDCD1 (0.38) MAPTLMNAALDH1A1NPC1TP53
SCHEMBL13000747 0.79 ALDH1A1 (0.44) PIK3CDPARP10PARP11MAPTLMNA
SCHEMBL18375348 0.77 LRRK2 (0.39) PIK3CDPARP10PARP11MAPTLMNA
SCHEMBL1129836 0.76 MGAM (0.41) PIK3CDMAPTLMNANOTUMALDH1A1
SCHEMBL19726599 0.73 KIF11 (0.44) PIK3CDPARP10PARP11MAPTLMNA
SCHEMBL18174563 0.73 IMPDH2 (0.45) PIK3CDPARP10PARP11MAPTLMNA
SCHEMBL18367730 0.73 CD274 (0.70) PIK3CDPARP10PARP11LRRK2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2952256-B1 METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2017-05-17 EP disclosed
EP-2952256-A1 METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS Deutschland GmbH (DE) 2015-12-09 EP disclosed
US-8932976-B2 Preparation of catalyst for bisphenols production DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 US disclosed
US-20100152028-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES LLC 2010-06-17 US disclosed
CN-101678354-A The Preparation of catalysts that is used for bisphenol production DOW GLOBAL TECHNOLOGIES INC 2010-03-24 CN disclosed