SCHEMBL22993156

SCHEMBL22993156

Cc1cc2c(-c3cccc(C(F)(F)F)c3)c3ccccc3c(-c3cccc4ccccc34)c2cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP1B1 Q16678 1/20 0.42
IKBKB O14920 1/20 0.41
BRD4 O60885 1/20 0.41
CNR2 P34972 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
ENPP1 P22413 1/20 0.39
MAPK14 Q16539 1/20 0.38
PARP1 P09874 1/20 0.37
MAOB P27338 1/20 0.37
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
ATM Q13315 1/20 0.37
MCL1 Q07820 1/20 0.37
BAD Q92934 1/20 0.37

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
SCHEMBL22993259 0.92 CYP1A1 (0.43) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22978407 0.92 CYP1A1 (0.47) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22993153 0.88 MAPT (0.39) ENPP1ESR1
SCHEMBL22992996 0.88 CYP1A1 (0.45) CYP1A1CYP1A2CYP1B1CNR2TDP1
SCHEMBL22993089 0.88 CYP1A1 (0.43) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22993317 0.87 PTPN5 (0.44) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22993318 0.85 ENPP1 (0.43) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22993301 0.85 CYP1A1 (0.47) CYP1A1CYP1A2CYP1B1CNR2TDP1
SCHEMBL22993085 0.84 PTPN5 (0.46) CYP1A1CYP1A2CYP1B1IKBKBBRD4
SCHEMBL22993031 0.82 TDP1 (0.44) CYP1A1CYP1A2CYP1B1IKBKBBRD4

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
US-20230363196-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2023-11-09 US disclosed
US-20230363196-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS INC. (CA) 2023-11-09 US disclosed
US-11751415-B2 Materials for forming a nucleation-inhibiting coating and devices incorporating same OTI LUMIONICS INC. (CA) 2023-09-05 US disclosed
US-11751415-B2 Materials for forming a nucleation-inhibiting coating and devices incorporating same OTI LUMIONICS INC. (CA) 2023-09-05 US disclosed
US-20210047536-A1 MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME OTI LUMIONICS, INC. (CA) 2021-02-18 US disclosed