SCHEMBL14101943

SCHEMBL14101943

CCOC(=O)C(O)(CC(=O)c1cc(C)cc(COC2CCCCO2)c1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 2/20 0.44
▸ EP300 Q09472 1/20 0.40
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ICAM1 P05362 1/20 0.33
▸ SELE P16581 1/20 0.33
▸ POLB P06746 2/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ LMNA P02545 1/20 0.31

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
SCHEMBL4723720 0.95 CREBBP (0.43) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4721279 0.78 CREBBP (0.52) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4312331 0.76 CREBBP (0.52) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4722474 0.74 CREBBP (0.42) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4309447 0.72 CREBBP (0.59) CREBBPEP300MEN1KMT2AICAM1
SCHEMBL4721231 0.71 CREBBP (0.45) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL22070520 0.69 CREBBP (0.42) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4724279 0.69 CREBBP (0.40) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4311026 0.68 CREBBP (0.47) CREBBPEP300MEN1KMT2ANPC1
SCHEMBL4315290 0.68 CREBBP (0.58) CREBBPEP300MEN1KMT2ANPC1

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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