SCHEMBL20083668

SCHEMBL20083668

C=Cc1ccc(OCC=O)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.31
▸ POLB P06746 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CACNA1B Q00975 1/20 0.31
▸ APBA1 Q02410 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TUBB1 Q9H4B7 2/20 0.30
▸ TUBB4A P04350 1/20 0.30
▸ TUBB P07437 1/20 0.30
▸ TUBA3C P0DPH7 1/20 0.30
▸ TUBA1B P68363 1/20 0.30
▸ TUBA4A P68366 1/20 0.30
▸ TUBB4B P68371 1/20 0.30
▸ TUBB3 Q13509 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
SCHEMBL30786251 0.75 LTA4H (0.43) SMN1; SMN2
SCHEMBL12036828 0.75 TUBB4A (0.36) ALDH1A1MAPTSMN1; SMN2TUBB1TUBB4A
SCHEMBL2726596 0.73 CA12 (0.42) CA12CA1CA9CA2CA7
SCHEMBL932015 0.73 KDM4E (0.38) —
SCHEMBL18951811 0.73 TUBB4A (0.51) CA12CA1CA9CA2CA7
SCHEMBL10841695 0.72 P4HTM (0.54) MAPTSMN1; SMN2
SCHEMBL30786097 0.71 HRH3 (0.51) —
SCHEMBL30648147 0.71 APP (0.51) ALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL27081518 0.71 APP (0.51) ALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL16248104 0.71 SRD5A1 (0.33) MAPTTUBB1TUBB4ATUBBTUBA3C

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-3312170-A1 1,4-DI-SUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-04-25 — — EP disclosed
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