SCHEMBL11201975

SCHEMBL11201975

Cc1ccccc1NC(CCNC(=O)CN1CCOCC1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ TSHR P16473 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ ALDH1A1 P00352 6/20 0.47
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.45
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ POLB P06746 2/20 0.42

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
SCHEMBL11204170 0.89 NPC1 (0.49) MEN1KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL11196455 0.86 TDP1 (0.49) USP2HTTMEN1KMT2ATSHR
SCHEMBL11200538 0.86 SMN1; SMN2 (0.57) USP2HTTMEN1KMT2ATSHR
SCHEMBL11196667 0.81 USP2 (0.50) USP2HTTMEN1KMT2ATSHR
SCHEMBL11200409 0.81 SMN1; SMN2 (0.49) USP2HTTMEN1KMT2ATSHR
SCHEMBL11193548 0.80 LMNA (0.47) HTTSMN1; SMN2ALDH1A1MAPTLMNA
SCHEMBL11200546 0.79 SMN1; SMN2 (0.52) USP2HTTMEN1KMT2ATSHR
SCHEMBL11196859 0.79 LMNA (0.49) USP2HTTTSHRSMN1; SMN2ALDH1A1
SCHEMBL11193818 0.78 USP2 (0.47) USP2HTTMEN1KMT2ACYP3A4
SCHEMBL11198251 0.76 TDP1 (0.62) HTTMEN1KMT2ATSHRCYP2C19

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-4379926-A DIURETICS AYERST, MCKENNA & HARRISON LTD. (CA) 1983-04-12 — — US disclosed
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