SCHEMBL4843348

SCHEMBL4843348

COC(=O)CCCc1cccc(CNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
P2RX7 Q99572 1/20 0.39
TRPA1 O75762 3/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RORC P51449 5/20 0.38
PTGER3 P43115 1/20 0.36
MMP8 P22894 2/20 0.36
MMP3 P08254 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL4843125 0.95 TRPA1 (0.39) TRPA1RORCPTGER3MMP8
SCHEMBL4833223 0.92 RORC (0.42) P2RX7TRPA1KMT2AKDM4ERORC
SCHEMBL4841652 0.91 NPC1 (0.41) NPC1P2RX7TRPA1KMT2AKDM4E
SCHEMBL4845058 0.91 RORC (0.40) NPC1P2RX7TRPA1KMT2ARORC
SCHEMBL4839704 0.91 TRPA1 (0.42) TRPA1RORCPTGER3MMP8MMP3
SCHEMBL4839795 0.91 TRPA1 (0.40) TRPA1RORCPTGER3MMP8
SCHEMBL4844451 0.90 RORC (0.40) NPC1P2RX7TRPA1KMT2ARORC
SCHEMBL4844703 0.90 NPC1 (0.39) NPC1P2RX7TRPA1KMT2AKDM4E
SCHEMBL4837961 0.90 P2RX7 (0.40) NPC1P2RX7TRPA1KMT2AKDM4E
SCHEMBL4842032 0.89 RORC (0.43) P2RX7TRPA1KMT2AKDM4ERORC

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-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 NPC1 51/4885P2RX7 908/4885TRPA1 368/4885

“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.