SCHEMBL1945004

SCHEMBL1945004

CC1(C)OB(c2cnn(C3CCCN(C(=O)O)C3)c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.39
KDM2A Q9Y2K7 7/20 0.35
KDM6B O15054 6/20 0.35
KDM5C P41229 6/20 0.35
KDM4C Q9H3R0 6/20 0.35
KDM3A Q9Y4C1 5/20 0.35
KDM4A O75164 3/20 0.35
USP30 Q70CQ3 1/20 0.35
KDM4E B2RXH2 2/20 0.33
HSD11B1 P28845 1/20 0.33
KDM5A P29375 2/20 0.33
ACHE P22303 3/20 0.33
BTK Q06187 2/20 0.32

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
SCHEMBL23211127 0.93 FFAR1 (0.41) FFAR1KDM2AKDM5CKDM4CUSP30
SCHEMBL23211118 0.93 FFAR1 (0.41) FFAR1KDM2AKDM5CKDM4CUSP30
SCHEMBL16342703 0.93 FFAR1 (0.41) FFAR1KDM2AKDM5CKDM4CUSP30
SCHEMBL2363986 0.88 FFAR1 (0.44) FFAR1USP30ACHE
SCHEMBL21858191 0.86 FFAR1 (0.38) FFAR1USP30KDM4E
SCHEMBL320321 0.86 FFAR1 (0.42) FFAR1USP30KDM5AACHE
SCHEMBL12539259 0.86 USP30 (0.51) FFAR1USP30HSD11B1
SCHEMBL1425500 0.86 USP30 (0.51) FFAR1USP30HSD11B1
SCHEMBL1425502 0.86 USP30 (0.51) FFAR1USP30HSD11B1
SCHEMBL23242984 0.83 FFAR1 (0.38) FFAR1USP30

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-8481524-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-09 US disclosed
US-20110136789-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-09 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-20110136789-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 FFAR1 2619/4885KDM2A 1291/4885KDM6B 1194/4885

“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.