SCHEMBL16616847

SCHEMBL16616847

O=C(/C=C/c1cccnc1Nc1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
RAB9A P51151 3/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
DHODH Q02127 2/20 0.54
MAPT P10636 7/20 0.53
MAPK1 P28482 1/20 0.53
LMNA P02545 4/20 0.49
NPC1 O15118 2/20 0.49
HPGD P15428 2/20 0.49
ATM Q13315 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
RECQL P46063 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
TP53 P04637 1/20 0.48
CASP1 P29466 1/20 0.48

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
SCHEMBL16616849 1.00 SMN1; SMN2 (0.54) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616766 0.95 SMN1; SMN2 (0.50) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616767 0.95 SMN1; SMN2 (0.50) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616736 0.95 MAPT (0.52) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616735 0.95 MAPT (0.52) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616358 0.95 MAPT (0.54) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616361 0.95 MAPT (0.54) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616409 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16616408 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9AKMT2AMEN1DHODH
SCHEMBL16625592 0.92 SMN1; SMN2 (0.47) SMN1; SMN2RAB9AKMT2AMEN1DHODH

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-9006451-B1 2-anilinonicotinyl based chalcones useful as potential anticancer agents and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-14 US disclosed
US-9006451-B1 2-anilinonicotinyl based chalcones useful as potential anticancer agents and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-14 US disclosed
US-9006451-B1 2-anilinonicotinyl based chalcones useful as potential anticancer agents and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-14 US disclosed
US-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-09 US disclosed
US-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-09 US disclosed
US-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-09 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-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof HCCS, WEE2, WEE1 SMN1; SMN2 4456/4885RAB9A 1415/4885KMT2A 2973/4885

“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.