SCHEMBL29952417

SCHEMBL29952417

OB(O)c1ccc(-n2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.59
▸ ATM Q13315 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ ENPP2 Q13822 3/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CA5B Q9Y2D0 1/20 0.44
▸ CA2 P00918 5/20 0.43
▸ CA1 P00915 4/20 0.43
▸ MGLL Q99685 1/20 0.43
▸ PTPN1 P18031 2/20 0.40
▸ POLB P06746 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ LPL P06858 1/20 0.37
▸ LIPG Q9Y5X9 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
SCHEMBL262197 1.00 KDM4E (0.59) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL29375327 1.00 KDM4E (0.59) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL12014934 0.94 CA1 (0.53) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL16689548 0.91 KDM4E (0.50) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL17885353 0.91 KDM4E (0.50) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL28640199 0.90 KDM4E (0.48) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL28595803 0.90 KDM4E (0.58) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL30471732 0.90 KDM4E (0.58) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL18525478 0.89 KDM4E (0.52) KDM4EATML3MBTL1ENPP2CA4
SCHEMBL17753312 0.87 L3MBTL1 (0.46) KDM4EATML3MBTL1ENPP2CA4

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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