SCHEMBL16627418

SCHEMBL16627418

CC(=O)c1cccnc1Nc1ccc(F)cc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.57
ALDH1A1 P00352 2/20 0.57
HPGD P15428 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
DHODH Q02127 6/20 0.49
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
NPC1 O15118 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL16627422 0.85 ALDH1A1 (0.58) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL16627414 0.84 RAB9A (0.79) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL16627416 0.82 ALDH1A1 (0.55) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL13748719 0.82 SMN1; SMN2 (0.53) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL16638725 0.81 ALDH1A1 (0.49) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL16627424 0.80 ALDH1A1 (0.53) RAB9AALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL16627410 0.79 ALDH1A1 (0.44) RAB9AALDH1A1HPGDSMN1; SMN2DHODH
SCHEMBL16616643 0.79 DHODH (0.76) RAB9AALDH1A1SMN1; SMN2DHODHLMNA
SCHEMBL16627420 0.77 ALDH1A1 (0.44) RAB9AALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL15636177 0.76 DHODH (0.71) RAB9AALDH1A1SMN1; SMN2DHODHLMNA

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 2 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-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 RAB9A 1415/4885ALDH1A1 1497/4885HPGD 1283/4885

“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.