SCHEMBL23764989

SCHEMBL23764989

Clc1ccc(-c2ccc3c(c2)sc2cccc(Br)c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.36
LIMK1 P53667 2/20 0.36
CYP1A2 P05177 3/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALOX5 P09917 1/20 0.33
CNR1 P21554 2/20 0.31
AHR P35869 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PTPN1 P18031 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL23765156 0.97 PGR (0.38) PGRLIMK1CYP1A2CYP1A1CYP1B1
SCHEMBL20391686 0.88 KDM4E (0.40) PGRLIMK1CYP1A2CYP1A1CYP1B1
SCHEMBL21622688 0.88 LIMK1 (0.40) LIMK1ALDH1A1MAPTHPGDRAB9A
SCHEMBL29533985 0.87 KDM4E (0.40) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL15989801 0.87 KDM4E (0.40) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL23764952 0.85 CYP2A6 (0.38) LIMK1CYP1A1CYP1B1ALDH1A1
SCHEMBL21742816 0.84 PDE3B (0.43) LIMK1KDM4ERAB9A
SCHEMBL23764996 0.82 LIMK1 (0.36) PGRLIMK1CYP1A2CYP1A1CYP1B1
SCHEMBL24969282 0.79 CYP1A2 (0.43) PGRLIMK1CYP1A2CYP1A1CYP1B1
SCHEMBL23764999 0.78 AHR (0.32) PGRCYP1A2AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023140528-A1 ORGANIC ELECTRIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-07-27 WO disclosed
WO-2021162384-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-19 WO disclosed