SCHEMBL24540340

SCHEMBL24540340

CCOC(=O)Cc1cc(C(C)(C)C)on1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
EGFR P00533 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL17653916 0.87 HDAC4 (0.40) KDM4ESMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL18623686 0.81 NPC1 (0.50) KDM4ESMN1; SMN2MEN1KMT2ANPC1
SCHEMBL17951578 0.78 EGFR (0.46) EGFRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL24540338 0.77 THRB (0.43) KDM4ESMN1; SMN2HPGDMEN1KMT2A
SCHEMBL352509 0.76 MAPK1 (0.49) EGFRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL17653949 0.76 MEN1 (0.43) KDM4ESMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL11645912 0.73 EGFR (0.60) EGFRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL9610944 0.73 MEN1 (0.44) EGFRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL27163685 0.72 NOTUM (0.55) KDM4ESMN1; SMN2HPGDNPC1RAB9A
SCHEMBL13200000 0.72 MAPT (0.53) KDM4ESMN1; SMN2HPGDMEN1KMT2A

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-2022133027-A1 SUBSTITUTED CYCLOHEXANECARBOXAMIDES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-06-23 WO disclosed