SCHEMBL1188883

SCHEMBL1188883

CONc1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
RAB9A P51151 3/20 0.47
PKM P14618 1/20 0.47
NPC1 O15118 3/20 0.45
GAA P10253 2/20 0.45
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 4/20 0.45
LMNA P02545 1/20 0.42
CYP2A6 P11509 1/20 0.42
PTGS2 P35354 2/20 0.42
ATM Q13315 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
NLRP1 Q9C000 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL29910198 0.86 NPC1 (0.41) RAB9ANPC1GAASMN1; SMN2MEN1
SCHEMBL11410077 0.80 RAB9A (0.40) TSHRRAB9APKMNPC1HTT
SCHEMBL11405715 0.79 NPC1 (0.43) TSHRRAB9APKMNPC1GAA
SCHEMBL11146268 0.78 SMN1; SMN2 (0.44) RAB9ANPC1GAAHTTSMN1; SMN2
SCHEMBL13724343 0.76 TDP1 (0.46) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL691644 0.76 TSHR (0.46) TSHRRAB9ANPC1GAASMN1; SMN2
SCHEMBL14520272 0.76 ALDH1A1 (0.46) TSHRRAB9ANPC1GAASMN1; SMN2
SCHEMBL812574 0.74 RAB9A (0.64) RAB9ANPC1GAAHTTSMN1; SMN2
SCHEMBL11421289 0.74 KCNH3 (0.50) RAB9ANPC1GAAHTTALDH1A1
SCHEMBL12200621 0.74 NPC1 (0.33) RAB9ANPC1GAASMN1; SMN2MAPT

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
CN-103596923-A Substituted 5-(cyclohex-2-en-1-yl)-penta-2,4-dienes and 5-(cyclohex-2-en-1-yl)-pent-2-en-4-ines as active agents against abiotic stress in plants BAYER CROPSCIENCE AG 2014-02-19 CN disclosed
US-20110155660-A1 MODIFIED MEMBRANE DOW GLOBAL TECHNOLOGIES LLC 2011-06-30 US disclosed
US-7882963-B2 modifying polyamide discriminating layer ( e.g metaphenylene diamine- trimesoyl chloride monomers) with aminoacetophenone or aminothiophenol; fouling resistant surface, improved salt rejection, antimicrobial properties, improved solute, and/or small organics rejection; for water purification DOW GLOBAL TECHNOLOGIES INC. (US) 2011-02-08 US disclosed
US-20090159527-A1 MODIFIED MEMBRANE DOW GLOBAL TECHNOLOGIES LLC 2009-06-25 US disclosed
WO-2007133362-A1 MODIFIED MEMBRANE DOW GLOBAL TECHNOLOGIES INC. (US) 2007-11-22 WO disclosed
EP-0053713-A1 Process for preparing 1-acetylamino-4-chloro-2,5 dimethoxybenzene HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-16 EP disclosed
US-4224340-A Anti-inflammatory compositions containing α-phenyl-N-phenylnitrone compounds WILLIAM H. RORER, INC. (US) 1980-09-23 US disclosed
US-4214003-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1980-07-22 US disclosed
US-4197314-A WITH A DIPHENYL NITRONE WILLIAM H. RORER, INC. (US) 1980-04-08 US disclosed
EP-0001994-A1 Process for preparing acetylaminobenzenes HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-30 EP disclosed
US-4153722-A ANTIINFLAMMATORY, A-PHENYL-N-PHENYLNITRONE WILLIAM H. RORER, INC. (US) 1979-05-08 US disclosed