SCHEMBL25949228

SCHEMBL25949228

COc1cccc(NC(=O)c2ccc(C)c(C=O)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.67
▸ NPC1 O15118 9/20 0.65
▸ RAB9A P51151 9/20 0.65
▸ ALDH1A1 P00352 3/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ TP53 P04637 2/20 0.65
▸ PKM P14618 1/20 0.65
▸ KMT2A Q03164 1/20 0.65
▸ NLRP3 Q96P20 1/20 0.61
▸ PLAU P00749 1/20 0.61
▸ KCNK3 O14649 2/20 0.60
▸ KCNK9 Q9NPC2 2/20 0.60
▸ TRPV1 Q8NER1 1/20 0.60
▸ HTT P42858 1/20 0.58

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
SCHEMBL25949199 0.86 RXFP1 (0.65) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL24071023 0.86 NPC1 (0.61) NPC1RAB9AALDH1A1SMN1; SMN2KCNK3
SCHEMBL25949195 0.84 MEN1 (0.66) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL10055020 0.82 NPC1 (0.94) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL22025454 0.82 RXFP1 (0.70) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL25337572 0.81 NPC1 (0.55) NPC1RAB9AALDH1A1SMN1; SMN2KCNK3
SCHEMBL22065404 0.81 RXFP1 (0.68) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4251968 0.81 RXFP1 (0.94) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL30862297 0.81 RXFP1 (0.94) RXFP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4248720 0.80 RXFP1 (0.76) RXFP1NPC1RAB9AALDH1A1SMN1; 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-20230227447-A1 BENZYLAMINE DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-07-20 — — 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-20230227447-A1 BENZYLAMINE DERIVATIVES AS DDRS INHIBITORS DDR2, DDR1, DDRGK1 RXFP1 414/4885NPC1 2973/4885RAB9A 2278/4885

“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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