SCHEMBL11670194

SCHEMBL11670194

CCC(CN(CC)c1cccc(C)c1)OC(=O)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ RAB9A P51151 3/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ JAK2 O60674 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HSD17B1 P14061 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ GAA P10253 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
SCHEMBL11671514 0.93 MAPT (0.43) KMT2AMEN1PPARGMAPTALDH1A1
SCHEMBL11670540 0.89 TDP1 (0.40) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL11671349 0.89 MTNR1A (0.46) KMT2AMAPTALDH1A1HTTLMNA
SCHEMBL11671695 0.88 KMT2A (0.43) KMT2AMAPTNPC1ALDH1A1KDM4E
SCHEMBL11671807 0.87 MAPT (0.40) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL11670864 0.86 KMT2A (0.36) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL11670393 0.83 KMT2A (0.43) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL11672528 0.82 CNR1 (0.41) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL11671481 0.82 MAPT (0.41) KMT2AMEN1MAPTRAB9ANPC1
SCHEMBL11671437 0.81 RAB9A (0.46) KMT2AMEN1PPARGRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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