SCHEMBL25895329

SCHEMBL25895329

COc1cccc(C)c1CN=C=NC(C)C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
HDAC4 P56524 1/20 0.30
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL23342609 0.91 CA12 (0.34) MIFSMN1; SMN2CA12CA1CA2
SCHEMBL23342427 0.86 SCN4A (0.31)
SCHEMBL23342426 0.80
SCHEMBL25895319 0.79 ACHE (0.34) SMN1; SMN2
SCHEMBL23341677 0.77 IDO1 (0.42) SMN1; SMN2CA12CA1CA2CA4
SCHEMBL23341679 0.74 CA12 (0.32) CA12CA1CA2CA7CA9
SCHEMBL25895336 0.74 CA1 (0.33) SMN1; SMN2CA12CA1CA2CA4
SCHEMBL23341664 0.71 TAAR1 (0.37) SMN1; SMN2
SCHEMBL23841328 0.71 CA12 (0.39) SMN1; SMN2CA12CA1CA2CA4
SCHEMBL1205557 0.71 CA12 (0.39) MIFSMN1; SMN2CA12CA1CA2

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-11739074-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-08-29 US disclosed
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 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 (2 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-11739074-B2 Ras inhibitors KRAS, NRAS, HRAS MIF 2076/4885SMN1; SMN2 3861/4885CA12 3895/4885
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS KRAS, HRAS, MTOR MIF 1281/4885SMN1; SMN2 1139/4885CA12 4624/4885

“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.