SCHEMBL3849040

SCHEMBL3849040

Ic1[c][nH]c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 3/20 0.40
GPR3 P46089 2/20 0.40
ALOX5 P09917 1/20 0.38
POLB P06746 1/20 0.35
KDM4E B2RXH2 4/20 0.34
AHR P35869 3/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 2/20 0.34
ATM Q13315 2/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
IMPDH2 P12268 2/20 0.33
IMPDH1 P20839 1/20 0.33
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32

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
SCHEMBL2987901 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL546371 0.71 CYP1A2 (0.42) ALDH1A1HSD17B10GPR3KDM4EAHR
SCHEMBL9723837 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL650736 0.71 KDM4E (0.41) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL570354 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL1639050 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL2073631 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL127256 0.71 ALDH1A1 (0.40) ALDH1A1HSD17B10GPR3ALOX5POLB
SCHEMBL6709570 0.69 KMT2A (0.46) ALDH1A1HSD17B10KDM4EAHRGAA
SCHEMBL718222 0.68 ALDH1A1 (0.41) ALDH1A1HSD17B10GPR3POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102675186-B Indol and eight-membered ring diene compound, synthetic method and application thereof in iprindole synthesis SHANGHAI INST ORGANIC CHEM 2014-11-12 CN claimed
CN-102675186-A Indol and eight-membered ring diene compound, synthetic method and application thereof in iprindole synthesis SHANGHAI INST ORGANIC CHEM 2012-09-19 CN claimed
CN-101842353-A 2, 3-substituted indole derivatives for treating viral infections SCHERING CORP 2010-09-22 CN disclosed
CN-101842374-A 2, 3-substituted azaindole derivatives for the treatment of viral infections SCHERING CORP 2010-09-22 CN disclosed
CN-101821252-A The indole derivatives and the using method thereof that replace CHERING CORP 2010-09-01 CN disclosed
CN-101631773-A 4 of treatment or prevention HCV and related viral infections, the 5-ring annulated indole derivatives SCHERING CORP 2010-01-20 CN disclosed
CN-101611025-A 5, the indole derivatives of 6-cyclisation and using method thereof SCHERING CORP (US) 2009-12-23 CN disclosed
CN-101611002-A 4, 5-cyclized indole derivatives for the treatment or prevention of HCV and related viral infections SCHERING CORP (US) 2009-12-23 CN disclosed
EP-1196624-B1 TEST MEDIA FOR IDENTIFICATION AND DIFFERENTIATION OF ENTEROBACTERIACEAE MICROLOGY LAB L L C (US) 2009-09-23 EP disclosed
CN-1230163-C 2-phenyl-1- [4- (2-aminoethoxy) -benzyl ] -indole in combination with an estrogen AMERICAN HOME PROD (US) 2005-12-07 CN disclosed
CN-1106383-C Estrogenic agents AMERICAN HOME PROD (US) 2003-04-23 CN disclosed
CN-1326347-A 2-phenyl-1-[4-(2-aminoethoxy)-benzyl]-indole in combination with estrogens AMERICAN HOME PROD (US) 2001-12-12 CN disclosed
CN-1170719-A Estrogenic agents AMERICAN HOME PROD (US) 1998-01-21 CN disclosed