SCHEMBL4844778

SCHEMBL4844778

COC(=O)c1ccc(CNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3cccc(C(F)(F)F)c3)cc2)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.42
ELANE P08246 1/20 0.41
KMT2A Q03164 1/20 0.40
RORC P51449 5/20 0.40
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
GNRHR P30968 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 2/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL4842663 0.94 TRPA1 (0.42) TRPA1ELANEKMT2ARORCLMNA
SCHEMBL4842736 0.92 GNRHR (0.43) TRPA1RORCLMNAGNRHRMAPT
SCHEMBL4039610 0.91 RAB9A (0.47) TRPA1KMT2ARORCLMNARAB9A
SCHEMBL4833445 0.89 RORC (0.45) TRPA1ELANERORCLMNA
SCHEMBL4838051 0.89 TRPA1 (0.41) TRPA1ELANEKMT2ARORCLMNA
SCHEMBL4841797 0.89 RORC (0.42) TRPA1ELANEKMT2ARORCLMNA
SCHEMBL4836346 0.88 RORC (0.42) TRPA1KMT2ARORCLMNANPC1
SCHEMBL4035280 0.84 LMNA (0.49) TRPA1ELANERORCLMNA
SCHEMBL4837253 0.84 RORC (0.41) RORCMAPT
SCHEMBL4834335 0.84 RORC (0.39) TRPA1RORCMAPT

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 TRPA1 368/4885ELANE 3852/4885KMT2A 1435/4885

“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.