SCHEMBL9408387

SCHEMBL9408387

C=CC(C(=O)O)C1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.39
▸ DPP8 Q6V1X1 2/20 0.39
▸ DPP9 Q86TI2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CCR1 P32246 1/20 0.37
▸ CCR5 P51681 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ ATM Q13315 1/20 0.35
▸ DRD2 P14416 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ PARP10 Q53GL7 1/20 0.34
▸ APP P05067 1/20 0.34
▸ CCR2 P41597 2/20 0.34
▸ NOTUM Q6P988 1/20 0.33

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
SCHEMBL9408288 0.96 DPP4 (0.37) DPP4DPP8DPP9ALDH1A1SMN1; SMN2
SCHEMBL9408246 0.85 NPC1 (0.36) ALDH1A1SMN1; SMN2CCR1NPC1RAB9A
SCHEMBL9408307 0.85 MAPT (0.41) CCR1MEN1KMT2APRCP
SCHEMBL9408359 0.85 HDAC2 (0.37) ALDH1A1NPC1RAB9AHDAC4HDAC2
SCHEMBL9408252 0.85 NPC1 (0.36) ALDH1A1SMN1; SMN2CCR1NPC1RAB9A
SCHEMBL9408242 0.85 HTR2C (0.44) NOTUM
SCHEMBL9408419 0.85 USP5 (0.38) CCR1APPCCR2
SCHEMBL9408217 0.82 IDO1 (0.47) ALDH1A1ATM
SCHEMBL9408374 0.82 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL9408211 0.82 GRIA1 (0.44) —

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
EP-0595144-A1 Cyclohexyl alkenoates as components of liquid crystalline mixtures F. HOFFMANN-LA ROCHE AG (CH) 1994-05-04 — — EP disclosed
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