SCHEMBL18802913

SCHEMBL18802913

CCC(C)c1ccc(C(OC)(C2CCCC2)C2CCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL18574330 0.78 MEN1 (0.35) KMT2ACYP2C9ALDH1A1MEN1MAPT
SCHEMBL17812602 0.77 KMT2A (0.44) KMT2ANPSR1CYP2C9ALDH1A1
SCHEMBL17812755 0.76 KMT2A (0.46) KMT2ANPSR1CYP2C9
SCHEMBL17812781 0.76 KMT2A (0.43) KMT2ANPSR1CYP2C9ALDH1A1MEN1
SCHEMBL18717781 0.75 ALDH1A1 (0.41) NPSR1CYP2C9ALDH1A1TSHRGAA
SCHEMBL17812628 0.75 KMT2A (0.45) KMT2ANPSR1ALDH1A1MEN1TSHR
SCHEMBL18732579 0.73 ALDH1A1 (0.42) KMT2ANPSR1CYP2C9ALDH1A1MEN1
SCHEMBL18810206 0.73 CSNK2A1 (0.36) KMT2AMEN1
SCHEMBL15179666 0.72 ALDH1A1 (0.41) NPSR1CYP2C9ALDH1A1TSHRGAA
SCHEMBL15179712 0.72 KMT2A (0.42) KMT2ANPSR1ALDH1A1MEN1TSHR

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
US-20170121437-A1 PATTERN FORMING METHOD, METHOD FOR MANUFACTURING ELECTRONIC DEVICE, ELECTRONIC DEVICE, ACTIVE-LIGHT-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM AND MASK BLANK FUJIFILM CORPORATION (JP) 2017-05-04 US disclosed