SCHEMBL15836660

SCHEMBL15836660

CN1CCN(S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3cccs3)cc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.70
▸ KMT2A Q03164 5/20 0.64
▸ HTT P42858 2/20 0.64
▸ LMNA P02545 2/20 0.64
▸ ALDH1A1 P00352 10/20 0.63
▸ MEN1 O00255 4/20 0.63
▸ RAB9A P51151 2/20 0.63
▸ GAA P10253 2/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.61
▸ HPGD P15428 3/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ POLB P06746 3/20 0.58
▸ CYP1A2 P05177 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ ALOX12 P18054 1/20 0.57
▸ GPR55 Q9Y2T6 1/20 0.57

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
SCHEMBL15836668 0.86 ALDH1A1 (0.69) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15836674 0.83 ALDH1A1 (0.63) MAPTKMT2ALMNAALDH1A1MEN1
SCHEMBL15836639 0.82 ALDH1A1 (0.65) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15836666 0.81 ALDH1A1 (0.69) KMT2AALDH1A1MEN1GAAHPGD
SCHEMBL15836657 0.78 MAPT (0.68) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15836652 0.77 KMT2A (0.72) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15836670 0.76 ALDH1A1 (1.00) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15840658 0.74 KMT2A (0.75) MAPTKMT2AHTTLMNAALDH1A1
SCHEMBL15836673 0.74 ALDH1A1 (0.78) KMT2AHTTLMNAALDH1A1MEN1
SCHEMBL14096400 0.74 MAPT (0.65) MAPTKMT2AHTTLMNAALDH1A1

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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 — — US disclosed
US-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 — — 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 MAPT 1076/4885KMT2A 3667/4885HTT 1693/4885

“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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