SCHEMBL23637451

SCHEMBL23637451

Clc1cc(C2(c3ccccc3)c3ccccc3-c3ccccc32)c2c(c1)oc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 7/20 0.42
WEE1 P30291 2/20 0.36
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TNKS O95271 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32

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
SCHEMBL23637361 0.91 PDK2 (0.37) AHRWEE1KDM4EMEN1LMNA
SCHEMBL23637486 0.89 AHR (0.35) AHRWEE1KDM4EMEN1MAPT
SCHEMBL24279298 0.85 AHR (0.43) AHRKDM4EMEN1LMNAMAPT
SCHEMBL29276498 0.84 SMN1; SMN2 (0.40) AHRKDM4EMEN1LMNAMAPT
SCHEMBL23098691 0.84 AHR (0.49) AHRKDM4EMEN1LMNAMAPT
SCHEMBL23637442 0.83 AHR (0.40) AHRWEE1KDM4EMEN1LMNA
SCHEMBL23637417 0.82 AHR (0.33) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL23098749 0.82 AHR (0.46) AHRWEE1TNKSGABRPGABRD
SCHEMBL23096710 0.81 KDM4E (0.31) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL27389917 0.81 AHR (0.35) AHRWEE1KDM4EMEN1LMNA

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
WO-2021141356-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-07-15 WO disclosed