SCHEMBL23309513

SCHEMBL23309513

COc1cccc(NC(=O)c2cc(F)nc(F)c2F)c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.63
▸ NPC1 O15118 6/20 0.63
▸ POLB P06746 1/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ TP53 P04637 2/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.56
▸ ALDH1A1 P00352 2/20 0.55
▸ KMT2A Q03164 4/20 0.54
▸ NLRP3 Q96P20 1/20 0.54
▸ PKM P14618 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ GRM4 Q14833 1/20 0.53

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
SCHEMBL23309593 0.89 GRM4 (0.52) RAB9ANPC1POLBSMN1; SMN2TP53
SCHEMBL23309477 0.87 ATF1 (0.51) RAB9ANPC1POLBSMN1; SMN2TP53
SCHEMBL23309612 0.87 GRM4 (0.47) RAB9ANPC1POLBSMN1; SMN2TP53
SCHEMBL23309511 0.87 KMT2A (0.52) RAB9ANPC1POLBSMN1; SMN2RXFP1
SCHEMBL23309585 0.86 KDM4E (0.52) RAB9ANPC1POLBSMN1; SMN2RXFP1
SCHEMBL23309617 0.86 NPC1 (0.54) RAB9ANPC1POLBSMN1; SMN2TP53
SCHEMBL23309615 0.85 P2RX1 (0.58) RAB9ANPC1ALDH1A1GAAGRM4
SCHEMBL23309536 0.83 MEN1 (0.55) RAB9ANPC1SMN1; SMN2TP53RXFP1
SCHEMBL23309575 0.82 RXFP1 (0.69) RAB9ANPC1SMN1; SMN2TP53RXFP1
SCHEMBL23309490 0.81 GAA (0.51) RAB9ANPC1POLBSMN1; SMN2TP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — 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-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL RAB9A 286/4885NPC1 412/4885POLB 1411/4885

“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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