SCHEMBL4876684

SCHEMBL4876684

O=C(O)Nc1ccc(-c2ccccc2)cn1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
WNT3A P56704 1/20 0.56
DGAT1 O75907 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL30338494 0.86 PTK2 (0.57) DEGS1MEN1KMT2AWNT3A
SCHEMBL23566420 0.84 DEGS1 (0.75) DEGS1MEN1KMT2ADGAT1NPC1
SCHEMBL224450 0.83 WNT3A (0.61) DEGS1MEN1KMT2AWNT3ADGAT1
SCHEMBL29359083 0.82 WNT3A (0.60) DEGS1MEN1KMT2AWNT3A
SCHEMBL16238156 0.82 NPC1 (0.61) DEGS1MEN1KMT2AWNT3ANPC1
SCHEMBL24932090 0.82 ALDH1A1 (0.56) DEGS1DGAT1NPC1RAB9A
SCHEMBL5125646 0.82 KDR (0.60) DEGS1MEN1KMT2AWNT3A
SCHEMBL18979459 0.81 DEGS1 (0.62) DEGS1MEN1KMT2ADGAT1NPC1
SCHEMBL31672284 0.81 DEGS1 (0.62) DEGS1MEN1KMT2ADGAT1NPC1
SCHEMBL21286264 0.80 WNT3A (0.78) DEGS1MEN1KMT2AWNT3ANPC1

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-117242060-A Isoindolinone compounds 蒙特罗萨医疗公司 2023-12-15 CN disclosed
US-7368458-B2 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-06 US disclosed
WO-2006076597-A1 BICYCLIC HETEROCYCLES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-20 WO disclosed
US-20060155126-A1 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2006-07-13 US 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-20060155126-A1 Bicyclic heterocycles as cannabinoid receptor modulators CNR1, CNR2, GPR18 DEGS1 157/4885MEN1 2914/4885KMT2A 1581/4885

“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.