SCHEMBL7544330

SCHEMBL7544330

Nc1c(Cl)cccc1C(=O)c1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
ALOX15 P16050 1/20 0.48
MAPT P10636 1/20 0.48
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
RECQL P46063 1/20 0.46
MAPK14 Q16539 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 1/20 0.44
PBRM1 Q86U86 1/20 0.43
GAA P10253 2/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.41
CDK2 P24941 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL2189708 0.83 ALDH1A1 (0.57) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL611462 0.80 MEN1 (0.54) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL30089319 0.80 MEN1 (0.48) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL23881561 0.80 MEN1 (0.48) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL2704894 0.79 ALDH1A1 (0.48) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL30402632 0.79 AGER (0.52) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL2704116 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL15608370 0.79 MAPK14 (0.50) ALDH1A1CES2CES1RECQLMAPK14
SCHEMBL250099 0.79 CES2 (0.71) ALDH1A1ALOX15MAPTCES2CES1
SCHEMBL30293901 0.79 CES2 (0.71) ALDH1A1ALOX15MAPTCES2CES1

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-20020183313-A1 1,4-benzodiazepinones and their uses as CCK antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-05 US disclosed
US-20020002163-A1 1,4-benzodiazepinones and their uses as CCK antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 US disclosed
US-6291452-B1 CHOLECYSTOKININ ANTAGONISTS. FUJISAWA PHARMACETICAL CO., LTD. (JP) 2001-09-18 US disclosed
EP-0934282-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 EP disclosed
WO-1998015535-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-04-16 WO disclosed
US-3941803-A 2-(Imidazol-1-yl)benzophenones THE UPJOHN COMPANY (US) 1976-03-02 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 (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-20020002163-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 ALDH1A1 1169/4885ALOX15 3842/4885MAPT 4445/4885
US-20020183313-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 ALDH1A1 1169/4885ALOX15 3842/4885MAPT 4445/4885

“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.