SCHEMBL11207941

SCHEMBL11207941

Cc1cccc(C)c1CCCC=Cc1nc[nH]c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.39
PARP1 P09874 2/20 0.36
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34
HSD17B10 Q99714 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ACP1 P24666 1/20 0.34
ALOX5 P09917 1/20 0.33
HRH2 P25021 1/20 0.33
HRH1 P35367 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
HTT P42858 2/20 0.32
MAPK1 P28482 1/20 0.32
HTR1D P28221 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP3A4 P08684 2/20 0.32

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
SCHEMBL10790690 0.96 TAAR1 (0.38) TAAR1PARP1MAPTLMNAHSD17B10
SCHEMBL11207361 0.83 ACP1 (0.42) TAAR1PARP1MAPTLMNAHSD17B10
SCHEMBL10794288 0.82 POLB (0.37) TAAR1PARP1LMNAKMT2AACP1
SCHEMBL11212853 0.76 EGFR (0.44) TAAR1LMNAHTTEGFR
SCHEMBL11293787 0.75 TAAR1 (0.48) TAAR1MAPTLMNAHSD17B10MEN1
SCHEMBL11205811 0.75 TAAR1 (0.32) TAAR1MAPTLMNAHSD17B10MEN1
SCHEMBL11210047 0.74 PARP1 (0.41) TAAR1PARP1MAPTACP1ALOX5
SCHEMBL10792750 0.74 CDC7 (0.39) TAAR1MAPTLMNAMEN1KMT2A
SCHEMBL11205137 0.73 PARP1 (0.36) TAAR1PARP1ACP1ALOX5CYP3A4
SCHEMBL10551020 0.73 TAAR1 (0.36) TAAR1PARP1MAPTLMNAHSD17B10

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
EP-0034474-B1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Farmos-Yhtyma Oy (FI) 1983-01-26 EP disclosed
US-4333947-A HYPOTENSIVE AGENTS, BACTERICIDES, FUNGICIDES FARMOS-YHTYMA OY (FI) 1982-06-08 US disclosed