SCHEMBL3084159

SCHEMBL3084159

CCCCCC1(c2ccc(O)cc2)C(=O)Nc2c1ccc(F)c2C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.42
MMP9 P14780 5/20 0.42
MMP3 P08254 2/20 0.42
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
CNR1 P21554 1/20 0.36
HTT P42858 1/20 0.36
GPR35 Q9HC97 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
CYP19A1 P11511 5/20 0.32
HSD17B10 Q99714 1/20 0.32
HSD17B3 P37058 1/20 0.31

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
SCHEMBL3093775 0.89 MMP2 (0.43) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3092417 0.86 MMP2 (0.39) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3084192 0.81 CNR1 (0.36) MMP2MMP9MMP3MMP8MMP13
SCHEMBL5482223 0.76 CNR1 (0.61) MMP2MMP9CNR1HTTGPR35
SCHEMBL3200621 0.73 CNR1 (0.57) MMP2MMP9CNR1HTTGPR35
SCHEMBL31003728 0.70 CNR1 (0.36) MMP2MMP9CNR1HTTGPR35
SCHEMBL3087572 0.68 CNR1 (0.37) MMP2MMP9CNR1HTTGPR35
SCHEMBL31003823 0.68 CNR1 (0.37) MMP2MMP9CNR1HTTGPR35
SCHEMBL31003782 0.67 CNR1 (0.36) MMP2MMP9CNR1HTTGPR35
SCHEMBL3085010 0.67 CNR1 (0.36) MMP2MMP9CNR1HTTGPR35

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100227863-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE COMPOUNDS TOPOTARGET A/S (DK) 2010-09-09 US claimed
US-20100227863-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE COMPOUNDS TOPOTARGET A/S (DK) 2010-09-09 US disclosed
US-20100227863-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE COMPOUNDS TOPOTARGET A/S (DK) 2010-09-09 US disclosed
US-20100227863-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE COMPOUNDS TOPOTARGET A/S (DK) 2010-09-09 US disclosed
WO-2008129075-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE-COMPOUNDS TOPOTARGET A/S (DK) 2008-10-30 WO 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-20100227863-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE COMPOUNDS TPH2, TPH1, HTR2C MMP2 2138/4885MMP9 3892/4885MMP3 2100/4885

“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.