SCHEMBL4841210

SCHEMBL4841210

COC(=O)c1ccc(OCCN)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
CFTR P13569 5/20 0.46
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPT P10636 2/20 0.42
ESRRA P11474 1/20 0.41
ALOX5AP P20292 2/20 0.40
PDK2 Q15119 1/20 0.40
NOTUM Q6P988 1/20 0.40
AR P10275 1/20 0.39
EPHX2 P34913 1/20 0.39

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
Hydrochloric Acid SCHEMBL4841202 0.99 THRA (0.46) THRATHRBCFTRCYP1A2CYP2C9
SCHEMBL16726459 0.88 THRA (0.60) THRATHRBCFTRMAPTESRRA
SCHEMBL25935035 0.88 THRA (0.54) THRATHRBCFTRCYP1A2CYP2C9
SCHEMBL25317633 0.86 THRA (0.47) THRATHRBCFTRCYP1A2CYP2C9
SCHEMBL27647625 0.86 THRA (0.50) THRATHRBCFTRCYP1A2CYP2C9
SCHEMBL27195871 0.84 THRA (0.60) THRATHRBCFTRALOX5APPDK2
SCHEMBL4838140 0.83 MAPT (0.46) MAPT
SCHEMBL1941888 0.82 CFTR (0.43) THRATHRBCFTRCYP1A2CYP2C9
SCHEMBL1942565 0.82 CYP1A2 (0.46) THRATHRBCFTRCYP1A2CYP2C9
Hydrochloric Acid SCHEMBL4838135 0.82 PARP10 (0.45) MAPT

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 THRA 900/4885THRB 642/4885CFTR 4038/4885

“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.