SCHEMBL343933

SCHEMBL343933

Cc1cnc(NC(=O)c2cc(Cl)ccc2Cl)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.58
SMN1; SMN2 Q16637 6/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
MAPT P10636 4/20 0.58
NFKB1 P19838 1/20 0.58
NFKB2 Q00653 1/20 0.58
RELA Q04206 1/20 0.58
NPC1 O15118 7/20 0.56
POLB P06746 1/20 0.56
PKM P14618 2/20 0.56
AHR P35869 1/20 0.54
ALDH1A1 P00352 4/20 0.53
GAA P10253 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
FFAR2 O15552 1/20 0.52

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
SCHEMBL14825055 0.89 RAB9A (0.58) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL10114085 0.88 KCNMA1 (0.61) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL27134454 0.86 RAB9A (0.60) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL345233 0.85 KCNMA1 (0.65) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL24074066 0.83 SMN1; SMN2 (0.72) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5835944 0.83 CDK2 (0.57) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL10114134 0.83 RAB9A (0.51) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7128930 0.83 RORC (0.59) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL10253529 0.78 RAB9A (0.67) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL15426983 0.76 SMN1; SMN2 (0.66) RAB9ASMN1; SMN2MEN1KMT2AMAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338467-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2012-12-25 US disclosed
US-20120015929-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2012-01-19 US disclosed
US-8058293-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2011-11-15 US disclosed
EP-2274306-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2011-01-19 EP disclosed
US-20090247500-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-10-01 US disclosed
WO-2009114566-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-09-17 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 (2 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-20120015929-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 RAB9A 502/4885SMN1; SMN2 3153/4885MEN1 2621/4885
US-20090247500-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 RAB9A 502/4885SMN1; SMN2 3153/4885MEN1 2621/4885

“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.