SCHEMBL22992995

SCHEMBL22992995

CC(C)(C)c1ccc(-c2ccc3c(-c4cccc5ccccc45)c4ccccc4c(-c4cccc(C(F)(F)F)c4)c3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
MAOB P27338 1/20 0.36
CNR2 P34972 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
TP53 P04637 1/20 0.36
KDM1A O60341 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
KIF11 P52732 4/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ESR1 P03372 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL22993014 0.92 KCNQ3 (0.39) KCNQ3KCNQ2GPR84KIF11CA12
SCHEMBL22993275 0.92 KCNQ3 (0.40) KCNQ3KCNQ2GPR84KIF11CA12
SCHEMBL22992996 0.92 CYP1A1 (0.45) CYP1A1CYP1A2CYP1B1MAOBCNR2
SCHEMBL22993548 0.91 CYP1A1 (0.44) CYP1A1CYP1A2CYP1B1MAOBCNR2
SCHEMBL22993041 0.90 GPR84 (0.40) CYP1A1CYP1A2CYP1B1MAOBGPR84
SCHEMBL22993317 0.90 PTPN5 (0.44) CYP1A1CYP1A2CYP1B1MAOBCNR2
SCHEMBL22993301 0.89 CYP1A1 (0.47) CYP1A1CYP1A2CYP1B1MAOBCNR2
SCHEMBL22993319 0.88 PGR (0.44) CYP1A1CYP1A2CYP1B1MAOBCNR2
SCHEMBL22993515 0.87 GPR84 (0.41) CYP1A1CYP1A2CYP1B1MAOBGPR84
SCHEMBL22993085 0.87 PTPN5 (0.46) CYP1A1CYP1A2CYP1B1KCNQ3KCNQ2

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