SCHEMBL19707828

SCHEMBL19707828

O=C(CNc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RHOC P08134 4/20 0.56
▸ RHOA P61586 4/20 0.56
▸ HTT P42858 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ P2RX1 P51575 2/20 0.50
▸ CNR1 P21554 1/20 0.50
▸ CES2 O00748 1/20 0.50
▸ KCNQ3 O43525 2/20 0.49
▸ KCNQ2 O43526 2/20 0.49
▸ KCNE1 P15382 2/20 0.49
▸ KCNQ1 P51787 2/20 0.49
▸ MGLL Q99685 1/20 0.48
▸ KCNQ5 Q9NR82 1/20 0.48
▸ PTGS1 P23219 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CCR2 P41597 1/20 0.47
▸ TP53 P04637 1/20 0.47

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
SCHEMBL19707481 0.86 MAPT (0.54) HTTALDH1A1P2RX1CES2PTGS1
SCHEMBL27676491 0.83 RHOC (0.53) RHOCRHOAALDH1A1HPGDP2RX1
SCHEMBL19707256 0.83 ERCC5 (0.55) ALDH1A1HPGDKCNQ3KCNQ2KCNE1
SCHEMBL19707219 0.82 NPC1 (0.49) HTTALDH1A1HPGDCNR1CES2
SCHEMBL19707493 0.81 CNR1 (0.53) ALDH1A1HPGDP2RX1CNR1MGLL
SCHEMBL23014506 0.80 CCR2 (0.63) RHOCRHOAALDH1A1CCR2TP53
SCHEMBL27816991 0.80 CES2 (0.59) ALDH1A1P2RX1CES2KCNQ3KCNQ2
SCHEMBL28057626 0.80 CES2 (0.59) HTTALDH1A1P2RX1CES2PTGS1
SCHEMBL11503483 0.79 DDR1 (0.59) RHOCRHOAHTTALDH1A1HPGD
SCHEMBL5131380 0.79 RHOC (0.80) RHOCRHOAHTTP2RX1KCNQ3

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-20190134005-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARM INC (US) 2019-05-09 — — US disclosed
WO-2017214505-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2017-12-14 — — WO 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-20190134005-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE UGCG, MAN2B1, GBA1 RHOC 3868/4885RHOA 3861/4885HTT 865/4885

“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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