SCHEMBL9976883

SCHEMBL9976883

CC(C)c1nc2ccccc2n1-c1ccc(-c2cc3ccc4ccccc4c3c3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 1/20 0.45
▸ PDE10A Q9Y233 3/20 0.42
▸ CYP1A2 P05177 3/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ PIK3CD O00329 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ GRM2 Q14416 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ESR1 P03372 2/20 0.34
▸ ESR2 Q92731 2/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ GRIA1 P42261 1/20 0.34
▸ CACNG8 Q8WXS5 1/20 0.34
▸ CACNG2 Q9Y698 1/20 0.34

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
SCHEMBL12912447 0.91 CRBN (0.44) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL9976919 0.87 CRBN (0.47) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL9611731 0.85 MAPK1 (0.54) PDE10ACYP1A2PIK3CDPIK3CALMNA
SCHEMBL12912429 0.84 CRBN (0.43) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL9976882 0.82 PDE10A (0.43) PDE10ACYP1A2CNR2MAPK1HTT
SCHEMBL9611911 0.81 ESR1 (0.55) MAPK1HTTESR1ESR2GRIA1
SCHEMBL9611805 0.81 CRBN (0.42) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL2604844 0.81 CNR2 (0.45) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL12912483 0.81 CRBN (0.43) CRBNPDE10ACYP1A2CNR2PIK3CD
SCHEMBL2604825 0.80 CRBN (0.47) CRBNPDE10ACYP1A2CNR2PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47654-E1 Organic electroluminescence device IDEMITSU KOASN CO., LTD. (JP) 2019-10-22 — — US disclosed
US-9126943-B2 Nitrogenated heterocyclic ring derivative and organic electroluminescent element comprising same IDEMITSU KOSAN CO., LTD. (JP) 2015-09-08 — — US disclosed
US-9126943-B2 Nitrogenated heterocyclic ring derivative and organic electroluminescent element comprising same IDEMITSU KOSAN CO., LTD. (JP) 2015-09-08 — — US disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
Send feedback