SCHEMBL16559111

SCHEMBL16559111

CCN(CC)c1cccc(C)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ NR3C1 P04150 2/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ FABP4 P15090 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ PGR P06401 1/20 0.36
▸ AR P10275 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ACP1 P24666 1/20 0.36
▸ BRD4 O60885 1/20 0.35
▸ BRD2 P25440 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
SCHEMBL27546965 0.84 ALDH1A1 (0.40) KDM4ENPSR1HSD17B10NR3C1KMT2A
SCHEMBL16559081 0.81 NR3C1 (0.42) KDM4ENPSR1HSD17B10NR3C1KMT2A
SCHEMBL4730928 0.79 MAPT (0.44) KDM4EKMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL20421624 0.78 CD44 (0.42) HSD17B10ALDH1A1HPGDTSHRCYP3A4
SCHEMBL29520654 0.78 CYP3A4 (0.46) KDM4ENPSR1ALDH1A1TSHRCYP3A4
SCHEMBL328909 0.78 CYP3A4 (0.46) KDM4ENPSR1ALDH1A1TSHRCYP3A4
SCHEMBL6282417 0.76 FABP4 (0.36) KDM4EHSD17B10ALDH1A1FABP4HTR7
SCHEMBL27867772 0.76 HNF4A (0.45) KDM4EKMT2AMEN1ALDH1A1HPGD
Lithium Ion SCHEMBL19732706 0.76 CYP3A4 (0.44) KDM4ENPSR1ALDH1A1TSHRCYP3A4
SCHEMBL21065758 0.76 CYP3A4 (0.44) KDM4ENPSR1ALDH1A1TSHRCYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170365786-A1 COMPOSITIONS COMPRISING AT LEAST ONE POLYMER AND AT LEAST ONE METAL COMPLEX AND TO ELECTROLUMINESCENT DEVICES CONTAINING SAID COMPOSITIONS MERCK PATENT GMBH (DE) 2017-12-21 — — US disclosed
US-20170365785-A1 COMPOSITIONS COMPRISING AT LEAST ONE POLYMER AND AT LEAST ONE SALT, AND ELECTROLUMINESCENT DEVICES CONTAINING SAID COMPOSITIONS MERCK PATENT GMBH (DE) 2017-12-21 — — US disclosed
US-9815940-B2 Polymers containing substituted triarylamine units and electroluminescent devices containing said polymers MERCK PATENT GMBH (DE) 2017-11-14 — — US disclosed
US-20150069303-A1 POLYMERS CONTAINING SUBSTITUTED TRIARYLAMINE UNITS AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS MERCK PATENT GMBH (DE) 2015-03-12 — — US disclosed
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