SCHEMBL19984947

SCHEMBL19984947

Cc1c(Cl)cc(S(=O)(=O)O)cc1NC(=O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.52
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ TRPV1 Q8NER1 2/20 0.41
▸ MAOB P27338 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ FAAH O00519 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ NPSR1 Q6W5P4 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
SCHEMBL19984916 0.90 CASR (0.49) CASRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL19985030 0.84 GAA (0.49) CASRKMT2AALDH1A1GAAATM
SCHEMBL14606515 0.83 KMT2A (0.52) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL4358581 0.75 KMT2A (0.50) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL31305186 0.75 POLB (0.52) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL177362 0.74 CASR (0.69) CASRALDH1A1
SCHEMBL14471604 0.74 CASR (0.56) CASRKMT2AMEN1POLBALDH1A1
SCHEMBL29739419 0.73 KMT2A (0.54) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL29739460 0.73 KMT2A (0.54) KMT2AMEN1POLBALDH1A1KDM4E
SCHEMBL2814999 0.73 ALDH1A1 (0.51) KMT2AMEN1POLBALDH1A1KDM4E

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
EP-3305760-A1 METHOD FOR PRODUCING ALKYLAMINE DERIVATIVE AND PRODUCTION INTERMEDIATE OF ALKYLAMINE DERIVATIVE AJINOMOTO CO., INC. (JP) 2018-04-11 — — EP disclosed
US-20180079715-A1 METHOD FOR PRODUCING ALKYLAMINE DERIVATIVE AND ITS PRODUCTION INTERMEDIATE OF ALKYLAMINE DERIVATIVE AJINOMOTO CO., INC. (JP) 2018-03-22 — — 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-20180079715-A1 METHOD FOR PRODUCING ALKYLAMINE DERIVATIVE AND ITS PRODUCTION INTERMEDIATE OF ALKYLAMINE DERIVATIVE CASR, TAAR1, UTS2R CASR 1/4885KMT2A 2343/4885MEN1 1606/4885

“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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