SCHEMBL16017234

SCHEMBL16017234

Cc1nc(C)c(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cc2)o1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 9/20 0.50
▸ ALDH1A1 P00352 8/20 0.50
▸ USP2 O75604 5/20 0.47
▸ POLB P06746 5/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ LMNA P02545 4/20 0.47
▸ HTT P42858 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ TSHR P16473 3/20 0.45
▸ STIM1 Q13586 3/20 0.42
▸ ORAI1 Q96D31 3/20 0.42
▸ ORAI2 Q96SN7 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ ESR2 Q92731 1/20 0.38

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
SCHEMBL14887577 0.89 HSD17B10 (0.55) HSD17B10ALDH1A1USP2POLBSMN1; SMN2
SCHEMBL16017262 0.88 GAA (0.48) HSD17B10ALDH1A1USP2POLBSMN1; SMN2
SCHEMBL14881333 0.88 STIM1 (0.50) HSD17B10ALDH1A1USP2POLBSMN1; SMN2
SCHEMBL16019776 0.87 ALDH1A1 (0.56) HSD17B10ALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL14887335 0.87 BACE1 (0.42) ALDH1A1SMN1; SMN2MAPTSTIM1ORAI1
SCHEMBL16019798 0.83 DGAT1 (0.46) ALDH1A1STIM1ORAI1ORAI2IL2
SCHEMBL16017213 0.83 GRM1 (0.48) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL14887591 0.82 STIM1 (0.46) HSD17B10ALDH1A1USP2POLBSMN1; SMN2
SCHEMBL16017203 0.82 RAB9A (0.51) ALDH1A1POLBSMN1; SMN2LMNAHTT
SCHEMBL14887576 0.80 SCN10A (0.44) MAPTSTIM1ORAI1ORAI2IL2

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 HSD17B10 3352/4885ALDH1A1 4409/4885USP2 3918/4885

“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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