SCHEMBL15033908

SCHEMBL15033908

CCCOc1cccc2c(C(C)CC)cccc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.44
CYP2A6 P11509 1/20 0.43
HTT P42858 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
HTR1B P28222 6/20 0.41
TSHR P16473 1/20 0.41
HTR1D P28221 1/20 0.40
NR2E1 Q9Y466 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL12891587 0.88 IDO1 (0.47) L3MBTL1KDM4EATMHTTHTR1B
SCHEMBL22500372 0.83 L3MBTL1 (0.60) L3MBTL1KDM4EATMHTTTSHR
SCHEMBL14015296 0.83 TSHR (0.40) L3MBTL1KDM4EATMHTTHTR1B
SCHEMBL8863052 0.82 CYP2A6 (0.56) CYP2A6CNR1CNR2HTR1BHTR1D
SCHEMBL30503979 0.82 CYP2A6 (0.56) CYP2A6CNR1CNR2HTR1BHTR1D
SCHEMBL14015293 0.81 TSHR (0.44) L3MBTL1KDM4EATMTSHRMEN1
SCHEMBL14461713 0.80 MAPT (0.50) L3MBTL1ATMTSHR
SCHEMBL14118329 0.80 HTR1B (0.48) KDM4EHTR1BTSHRHTR1DNR2E1
SCHEMBL10183537 0.78 HTR1B (0.46) KDM4EHTR1BHTR1DNR2E1MEN1
SCHEMBL10182868 0.77 TSHR (0.41) L3MBTL1KDM4EATMHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130157463-A1 NEAR-INFRARED ABSORBING FILM COMPOSITION FOR LITHOGRAPHIC APPLICATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-06-20 US disclosed