SCHEMBL16017242

SCHEMBL16017242

Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ POLB P06746 3/20 0.54
▸ MAPT P10636 8/20 0.52
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ XDH P47989 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ HPGD P15428 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ GAA P10253 1/20 0.47
▸ DGAT1 O75907 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ NR1H4 Q96RI1 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HTT P42858 1/20 0.47

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
SCHEMBL16017208 0.91 MEN1 (0.56) MEN1KMT2APOLBMAPTCYP1A2
SCHEMBL16018228 0.89 STIM1 (0.49) MEN1KMT2APOLBMAPTCYP1A2
SCHEMBL16017203 0.88 RAB9A (0.51) MEN1KMT2APOLBMAPTCYP1A2
SCHEMBL16018202 0.84 STIM1 (0.61) MEN1KMT2APOLBMAPTCYP1A2
SCHEMBL16017262 0.81 GAA (0.48) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL12181712 0.80 LMNA (0.51) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL14885675 0.80 MEN1 (0.50) MEN1KMT2APOLBMAPTCYP1A2
SCHEMBL16017234 0.79 HSD17B10 (0.50) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL16019775 0.79 GAA (0.46) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL15164962 0.78 STIM1 (0.46) MEN1KMT2AMAPTHPGDNPSR1

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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 — — US disclosed
US-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 — — 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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MEN1 2958/4885KMT2A 4706/4885POLB 4774/4885

“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.

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