SCHEMBL3085338

SCHEMBL3085338

Cc1c(F)ccc2c1NC(=O)C2(O)C1CCCCCC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.43
BRD2 P25440 1/20 0.33
BRD3 Q15059 1/20 0.33
BRDT Q58F21 1/20 0.33
POLB P06746 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 2/20 0.32
APOBEC3A P31941 1/20 0.32
HTT P42858 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
HDAC4 P56524 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPK14 Q16539 1/20 0.30
ADAMTS5 Q9UNA0 1/20 0.30
CASP6 P55212 1/20 0.30
IDO1 P14902 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3090110 1.00 BRD4 (0.43) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3093485 0.99 BRD4 (0.42) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3076715 0.86 BRD4 (0.40) BRD4BRD2BRD3BRDTPOLB
SCHEMBL31003804 0.86 BRD4 (0.40) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3078103 0.86 BRD4 (0.40) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3089769 0.86 BRD4 (0.45) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3092384 0.86 BRD4 (0.40) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3082149 0.86 BRD4 (0.45) BRD4BRD2BRD3BRDTPOLB
SCHEMBL31003800 0.85 BRD4 (0.39) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3089780 0.85 BRD4 (0.39) BRD4BRD2BRD3BRDTPOLB

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 4 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 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 BRD4 616/4885BRD2 1442/4885BRD3 1098/4885

“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.