SCHEMBL11200792

SCHEMBL11200792

CCCC(=NO)c1ccc[nH]1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 1/20 0.41
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL17988364 0.85 TSHR (0.39) MEN1KMT2ACYP1A2TSHRNPC1
SCHEMBL3072018 0.85 TSHR (0.39) MEN1KMT2ACYP1A2TSHRNPC1
SCHEMBL3170534 0.73 TSHR (0.67) MAPTMEN1KMT2ATSHRNPC1
SCHEMBL3464105 0.70
SCHEMBL2491802 0.70
Butyric Acid SCHEMBL28173249 0.69 TSHR (0.61) MEN1KMT2ATSHRNPC1RAB9A
SCHEMBL13656517 0.69 TSHR (0.41) MEN1KMT2ACYP1A2CYP2D6TSHR
SCHEMBL14604957 0.68 ATM (0.54) MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5449384 0.68 ATM (0.54) MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5449388 0.68 ATM (0.54) MAPTMEN1KMT2ASMN1; SMN2

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-0094572-A2 1-Azolyl-oximino-butane derivatives, process for their preparation and their use as fungicides and plant growth regulators BAYER AG (DE) 1983-11-23 EP disclosed