SCHEMBL7296573

SCHEMBL7296573

O=C1CCc2cc(NC(=O)C3CCN(CCSc4ccccc4)CC3)ccc2N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ TP53 P04637 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ TRPV1 Q8NER1 1/20 0.44
▸ GAA P10253 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CARM1 Q86X55 1/20 0.44
▸ PRMT6 Q96LA8 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM1A O60341 1/20 0.44
▸ HDAC3 O15379 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ HDAC9 Q9UKV0 1/20 0.43
▸ MAP4K1 Q92918 1/20 0.43
▸ MEN1 O00255 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
SCHEMBL7295865 0.84 ROCK2 (0.60) SMYD3LMNAGAAALDH1A1KMT2A
SCHEMBL7294386 0.80 SMYD3 (0.55) SMYD3USP2TP53LMNATRPV1
SCHEMBL7287369 0.79 TP53 (0.51) SMYD3TP53LMNATRPV1GAA
SCHEMBL7297231 0.76 SMYD3 (0.61) SMYD3TP53LMNAGAAALDH1A1
Hydrochloric Acid SCHEMBL7309309 0.75 KDM1A (0.42) KDM1AMEN1KMT2A
SCHEMBL7294948 0.74 PRKAB2 (0.56) TP53
SCHEMBL10365448 0.70 MAP4K1 (0.65) TP53TRPV1GAASMN1; SMN2HDAC3
SCHEMBL14619598 0.69 MCHR1 (0.53) CARM1PRMT6
SCHEMBL14619828 0.68 MCHR1 (0.52) ALDH1A1
SCHEMBL7374128 0.68 LMNA (0.58) LMNAGAAKDM1AKMT2AROCK2

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-0255134-A2 Carbostyril derivatives and salts thereof, process for preparing them, and cardiotonic composition containing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-02-03 — — EP disclosed
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