SCHEMBL25722352

SCHEMBL25722352

CNc1ccccc1NC(=O)/C=C/c1cccnc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.59
▸ RAB9A P51151 3/20 0.59
▸ NAMPT P43490 14/20 0.57
▸ HDAC1 Q13547 2/20 0.57
▸ TRPV1 Q8NER1 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ JUN P05412 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ GPR55 Q9Y2T6 1/20 0.55
▸ EGFR P00533 1/20 0.52
▸ MMP1 P03956 1/20 0.52
▸ MMP2 P08253 1/20 0.52
▸ MMP9 P14780 1/20 0.52

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
SCHEMBL13352236 0.86 MMP1 (0.72) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL25725288 0.86 NAMPT (0.54) NPC1RAB9ANAMPTKDM4EJUN
SCHEMBL25722348 0.85 NAMPT (0.56) NPC1RAB9ANAMPTEGFR
SCHEMBL25722346 0.85 NAMPT (0.58) NPC1RAB9ANAMPTKDM4EJUN
SCHEMBL25722340 0.84 HDAC1 (0.77) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL30387813 0.83 TRPM2 (0.64) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL13320663 0.83 TRPM2 (0.64) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL4185775 0.83 TRPM2 (0.64) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL4185773 0.83 TRPM2 (0.64) NPC1RAB9ANAMPTHDAC1TRPV1
SCHEMBL10118164 0.81 RAB9A (0.67) NPC1RAB9ANAMPTKDM4EJUN

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-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-06-29 — — US disclosed
US-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-06-29 — — 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-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer SALL4, GLI2, GLI1 NPC1 3763/4885RAB9A 2121/4885NAMPT 1176/4885

“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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