SCHEMBL23309711

SCHEMBL23309711

COc1cc(NC(=O)c2cc(F)nc(F)c2F)ccc1C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 4/20 0.53
▸ KMT2A Q03164 6/20 0.46
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ KCNK3 O14649 2/20 0.43
▸ KCNK9 Q9NPC2 2/20 0.43
▸ AHR P35869 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ TOP1 P11387 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ PDE4B Q07343 1/20 0.42

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
SCHEMBL23309497 0.90 KMT2A (0.57) GRM4KMT2ANPC1RAB9AMAPT
SCHEMBL23309483 0.86 CYP1A2 (0.52) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23309702 0.85 ALDH1A1 (0.55) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23309480 0.84 ALDH1A1 (0.53) KMT2AMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL23309566 0.82 ALDH1A1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL23309539 0.82 NPC1 (0.52) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23309492 0.82 RAB9A (0.45) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23309617 0.82 NPC1 (0.54) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL23309533 0.82 ALDH1A1 (0.43) GRM4KMT2ANPC1RAB9AMAPT
SCHEMBL23309730 0.81 KMT2A (0.47) KMT2ANPC1RAB9AMAPTSMN1; SMN2

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 GRM4 2885/4885KMT2A 2360/4885NPC1 412/4885

“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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