SCHEMBL11278037

SCHEMBL11278037

NC(=O)N(c1ccccc1)c1ccnnc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.44
ALDH1A1 P00352 4/20 0.41
HCAR2 Q8TDS4 1/20 0.40
KMT2A Q03164 3/20 0.38
HDAC4 P56524 2/20 0.38
POLB P06746 2/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD17B10 Q99714 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
TSHR P16473 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL17460006 0.86 NPSR1 (0.47) NPSR1ALDH1A1HCAR2KMT2AHDAC4
SCHEMBL5474563 0.82 NPSR1 (0.50) NPSR1ALDH1A1KMT2APOLBNPC1
SCHEMBL28148401 0.81 NPSR1 (0.64) NPSR1ALDH1A1KMT2APOLBNPC1
SCHEMBL75885 0.81 NPSR1 (0.64) NPSR1ALDH1A1KMT2APOLBNPC1
SCHEMBL75883 0.81 NPSR1 (0.64) NPSR1ALDH1A1KMT2APOLBNPC1
SCHEMBL1648430 0.81 KCNA5 (0.47) NPSR1ALDH1A1HCAR2NPC1HTT
Hydrochloric Acid SCHEMBL27470915 0.79 KCNA5 (0.46) NPSR1ALDH1A1HCAR2NPC1HTT
Urea SCHEMBL23005263 0.79 NPSR1 (0.61) NPSR1ALDH1A1KMT2APOLBNPC1
Water SCHEMBL27782253 0.79 NPSR1 (0.61) NPSR1ALDH1A1KMT2APOLBNPC1
SCHEMBL28023499 0.79 NPSR1 (0.61) NPSR1ALDH1A1KMT2APOLBNPC1

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
EP-0052668-A1 N-(4-pyridazinyl)-N'-phenylureas and -thioureas as well as plant growth regulators containing same Shudo, Koichi, Prof. Dr. (JP) 1982-06-02 EP disclosed