SCHEMBL5523784

SCHEMBL5523784

NC(=O)Nc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.67
KMT2A Q03164 8/20 0.67
LMNA P02545 7/20 0.67
MAPT P10636 6/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
HTT P42858 2/20 0.67
ALDH1A1 P00352 7/20 0.58
RECQL P46063 1/20 0.58
HCRTR1 O43613 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C19 P33261 1/20 0.57
TRPV1 Q8NER1 1/20 0.55
POLB P06746 1/20 0.55
CA1 P00915 1/20 0.55
MMP2 P08253 1/20 0.55
CA14 Q9ULX7 1/20 0.55
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54

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
SCHEMBL11255805 0.86 LMNA (0.58) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL2853073 0.85 LMNA (0.73) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL2853072 0.85 LMNA (0.73) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL20560143 0.84 LMNA (0.67) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL584346 0.84 ALDH1A1 (0.73) MEN1KMT2ALMNAMAPTSMN1; SMN2
Nitric Acid SCHEMBL3859433 0.83 LMNA (0.58) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL27761089 0.82 MAPK1 (0.54) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL6717028 0.82 LMNA (0.64) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL5881545 0.81 LMNA (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL9843646 0.81 LMNA (0.66) MEN1KMT2ALMNAMAPTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101875961-A Be used to prevent and treat associated conditions and as the diaryl and the aryl heteroaryl urea derivatives of 5-HT2A serotonin receptor modulator ARENA PHARM INC 2010-11-03 CN disclosed
CN-101871931-A Be used to prevent and treat associated conditions and as the diaryl and the aryl heteroaryl urea derivatives of 5-HT2A serotonin receptor modulator ARENA PHARM INC 2010-10-27 CN disclosed
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 US disclosed
CN-1826322-A Diaryl and arylheteroaryl urea derivatives as modulators of the 5-HT 2A serotonin receptor for the prevention and treatment of related disorders ARENA PHARM INC (US) 2006-08-30 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 MEN1 647/4885KMT2A 792/4885LMNA 2932/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.