SCHEMBL15528787

SCHEMBL15528787

CCOc1ccc(NC(=O)c2ccncc2F)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.64
RAB9A P51151 11/20 0.63
NPC1 O15118 10/20 0.63
SMN1; SMN2 Q16637 6/20 0.63
TP53 P04637 5/20 0.63
POLB P06746 2/20 0.63
LMNA P02545 3/20 0.60
STIM1 Q13586 1/20 0.59
ORAI1 Q96D31 1/20 0.59
MAPT P10636 4/20 0.56
PKM P14618 3/20 0.56
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 2/20 0.56
GAA P10253 1/20 0.56
ALOX15 P16050 1/20 0.56
MEN1 O00255 3/20 0.55
HTT P42858 2/20 0.55
MITF O75030 1/20 0.55
MAPK1 P28482 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL18979244 1.00 KMT2A (0.64) KMT2ARAB9ANPC1SMN1; SMN2TP53
SCHEMBL15528735 0.82 RAB9A (0.67) KMT2ARAB9ANPC1SMN1; SMN2TP53
SCHEMBL18027793 0.81 STIM1 (0.57) KMT2ARAB9ANPC1SMN1; SMN2TP53
SCHEMBL18993438 0.78 HTT (0.55) KMT2ARAB9ANPC1SMN1; SMN2POLB
SCHEMBL28072916 0.78 HTT (0.67) KMT2ARAB9ANPC1LMNASTIM1
SCHEMBL16496746 0.77 RAB9A (1.00) KMT2ARAB9ANPC1SMN1; SMN2TP53
SCHEMBL15529280 0.77 KDM4C (0.58) KMT2ARAB9ANPC1SMN1; SMN2TP53
SCHEMBL986127 0.76 STIM1 (0.53) KMT2ARAB9ANPC1SMN1; SMN2POLB
SCHEMBL18010034 0.76 HTT (0.52) KMT2ARAB9ANPC1SMN1; SMN2POLB
SCHEMBL29013030 0.75 LMNA (1.00) KMT2ARAB9ANPC1SMN1; SMN2TP53

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
EP-2846803-B1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ALPHARMAGEN LLC (US) 2017-06-21 EP disclosed
US-20150099758-A1 Alpha 7 Nicotinic Acetylcholine Receptor Allosteric Modulators, Their Derivatives and Uses Thereof ANVYL LLC (US) 2015-04-09 US disclosed
EP-2846803-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF Anvyl, LLC (US) 2015-03-18 EP disclosed
WO-2013169889-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ANVYL LLC (US) 2013-11-14 WO 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-20150099758-A1 Alpha 7 Nicotinic Acetylcholine Receptor Allosteric Modulators, Their Derivatives and Uses Thereof CHRNA7, CHRNA1, CHRNA2 KMT2A 2959/4885RAB9A 1416/4885NPC1 2328/4885

“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.