SCHEMBL4841425

SCHEMBL4841425

O=C(NCCOc1cccnc1)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(-c2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
RORC P51449 11/20 0.42
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 1/20 0.39
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL4841404 0.92 RORC (0.42) RORC
SCHEMBL4840605 0.88 RORC (0.44) RORC
SCHEMBL4031510 0.88 RORC (0.40) RORC
SCHEMBL4039810 0.88 MEN1 (0.51) KMT2ARORCCYP11B1CYP11B2MAPT
SCHEMBL4036655 0.87 RORC (0.39) RORC
SCHEMBL4840319 0.87 RORC (0.43) RORC
SCHEMBL4833611 0.86 RORC (0.44) RORC
SCHEMBL4837216 0.86 RORC (0.43) RORCMAPTMAPK1
SCHEMBL4035496 0.86 RORC (0.41) RORCMAPT
SCHEMBL4036289 0.86 NAMPT (0.47) KMT2ARORCKDM4EMEN1CYP3A4

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 KMT2A 1435/4885RORC 1777/4885KDM4E 1574/4885

“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.