SCHEMBL13837369

SCHEMBL13837369

Cc1ccc(C(=O)c2ccc(Oc3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(C)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 5/20 0.51
▸ ACACB O00763 1/20 0.49
▸ ACACA Q13085 1/20 0.49
▸ MAPK14 Q16539 1/20 0.46
▸ HSD17B1 P14061 1/20 0.46
▸ HSD17B2 P37059 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ PTGES O14684 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ MMP13 P45452 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.44
▸ ELANE P08246 1/20 0.44

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
SCHEMBL12252096 0.95 ALOX5 (0.47) SRD5A2ACACBACACAALDH1A1LMNA
SCHEMBL19773619 0.93 SRD5A2 (0.56) SRD5A2MAPK14HSD17B1HSD17B2ALDH1A1
SCHEMBL18828187 0.93 SRD5A2 (0.56) SRD5A2MAPK14HSD17B1HSD17B2ALDH1A1
SCHEMBL12256026 0.92 ALOX5 (0.50) SRD5A2ACACBACACAHSD17B1HSD17B2
SCHEMBL12012656 0.92 ALOX5 (0.50) SRD5A2ACACBACACAHSD17B1HSD17B2
SCHEMBL2623414 0.92 ALOX5 (0.50) SRD5A2ACACBACACAHSD17B1HSD17B2
SCHEMBL13837372 0.91 FFAR4 (0.49) SRD5A2ACACBACACAMAPK14HSD17B1
SCHEMBL12757136 0.91 SRD5A2 (0.61) SRD5A2ACACBACACAMAPK14ALDH1A1
SCHEMBL13628166 0.90 SRD5A2 (0.60) SRD5A2ACACBACACALMNAPTGES
SCHEMBL13599719 0.89 LMNA (0.48) ALDH1A1LMNAMMP13NPC1HPGD

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-20120286653-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL ILLUMINATOR MITSUBISHI CHEMICAL CORPORATION (JP) 2012-11-15 — — US disclosed
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