SCHEMBL31428828

SCHEMBL31428828

Cc1ccc2[nH]c(C(=O)N3CCOCC3)cc2n1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ HRH3 Q9Y5N1 7/20 0.48
▸ HRH4 Q9H3N8 6/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SPR P35270 1/20 0.45
▸ CCNC P24863 1/20 0.44
▸ CDK8 P49336 1/20 0.44
▸ HASPIN Q8TF76 1/20 0.44
▸ SYK P43405 2/20 0.44

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
SCHEMBL30552687 0.85 POLB (0.59) POLBSMN1; SMN2HRH3HRH4MEN1
SCHEMBL25431128 0.85 POLB (0.59) POLBSMN1; SMN2HRH3HRH4MEN1
SCHEMBL31428559 0.82 POLB (0.56) POLBSMN1; SMN2HRH3HRH4NPC1
SCHEMBL30163500 0.82 POLB (0.56) POLBSMN1; SMN2HRH3HRH4NPC1
SCHEMBL25376559 0.81 POLB (0.55) POLBSMN1; SMN2HRH3HRH4MEN1
SCHEMBL14845692 0.79 NPC1 (0.76) POLBSMN1; SMN2HRH3HRH4NPC1
SCHEMBL13175659 0.77 AKR1C3 (0.70) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL18889251 0.77 HRH4 (0.60) POLBSMN1; SMN2HRH3HRH4NPC1
SCHEMBL8264513 0.77 FGFR1 (0.55) SMN1; SMN2KMT2A
SCHEMBL2770082 0.75 HRH4 (0.71) POLBSMN1; SMN2HRH3HRH4NPC1

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 — — 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS POLB 3285/4885SMN1; SMN2 4832/4885HRH3 2324/4885

“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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