SCHEMBL4722474

SCHEMBL4722474

CON(C)C(=O)c1cc(C)cc(COC2CCCCO2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 2/20 0.42
▸ EP300 Q09472 1/20 0.42
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ICAM1 P05362 1/20 0.36
▸ SELE P16581 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ RAB9A P51151 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ HSD17B10 Q99714 3/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32

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
SCHEMBL4721279 0.85 CREBBP (0.52) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL14291727 0.78 NPC1 (0.39) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4723720 0.76 CREBBP (0.43) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4309447 0.76 CREBBP (0.59) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4312331 0.75 CREBBP (0.52) CREBBPEP300MEN1KMT2ARAB9A
SCHEMBL4721231 0.75 CREBBP (0.45) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4724279 0.74 CREBBP (0.40) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL14852475 0.74 CREBBP (0.41) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL14101943 0.74 CREBBP (0.44) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4315290 0.74 CREBBP (0.58) CREBBPEP300MEN1KMT2AICAM1

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-1953147-A1 HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF Japan Tobacco, Inc. (JP) 2008-08-06 — — EP disclosed
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