SCHEMBL23972318

SCHEMBL23972318

Cc1ccc(CN(C)C(=O)N2CCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.52
▸ LIPE Q05469 1/20 0.48
▸ RAB9A P51151 3/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ TPSAB1 Q15661 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ GAA P10253 1/20 0.43

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
SCHEMBL26027797 0.88 KMT2A (0.54) HRH3RAB9AKMT2AMEN1MAPT
SCHEMBL13838899 0.85 HPGD (0.59) HRH3RAB9AALDH1A1KMT2AMEN1
SCHEMBL26027577 0.85 HRH3 (0.53) HRH3RAB9AALDH1A1KMT2AMEN1
SCHEMBL3132249 0.84 SMN1; SMN2 (0.54) HRH3RAB9AALDH1A1MAPTNPC1
SCHEMBL26713940 0.84 HRH3 (0.49) HRH3RAB9AALDH1A1KMT2AMEN1
SCHEMBL13838900 0.78 HPGD (0.61) HRH3RAB9AALDH1A1KMT2AMEN1
SCHEMBL26184739 0.78 RAB9A (0.48) HRH3LIPERAB9AALDH1A1KMT2A
SCHEMBL13838915 0.77 HRH3 (0.46) HRH3ALDH1A1KMT2AMEN1MAPT
SCHEMBL23973025 0.77 HRH3 (0.44) HRH3TPSAB1
SCHEMBL25668719 0.76 GAA (0.62) RAB9AALDH1A1KMT2AMEN1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4183415-A1 TRPV4 INHIBITOR AS THERAPEUTIC DRUG FOR EYE DISEASE RaQualia Pharma Inc. (JP) 2023-05-24 — — EP disclosed
WO-2021221169-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2021-11-04 — — WO disclosed
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