SCHEMBL2015237

SCHEMBL2015237

NC(=O)c1cccc(-c2ccc(C=O)s2)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 4/20 0.59
ERN1 O75460 6/20 0.51
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2E1 P05181 1/20 0.49
CYP2A6 P11509 1/20 0.49
CYP2B6 P20813 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPT P10636 1/20 0.45
APP P05067 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PARP1 P09874 1/20 0.42
IKBKB O14920 2/20 0.42
CYP1A2 P05177 1/20 0.42
BTK Q06187 1/20 0.42
PFKFB3 Q16875 1/20 0.42

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
SCHEMBL2557368 0.86 HDAC1 (0.57) PRF1ERN1CYP3A4CYP2C9CYP2E1
SCHEMBL2015377 0.84 PRF1 (0.56) PRF1ERN1CYP3A4CYP2C9CYP2E1
SCHEMBL3636086 0.77 HPGDS (0.65) PRF1HSD17B1HSD17B2HDAC1HDAC6
SCHEMBL70783 0.76 APP (0.67) PRF1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL12634253 0.75 PRF1 (1.00) PRF1
SCHEMBL2045436 0.75 PRF1 (1.00) PRF1
SCHEMBL2045434 0.75 PRF1 (1.00) PRF1
SCHEMBL9199395 0.74 CYP2E1 (0.54) PRF1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL2016059 0.74 HSD17B1 (0.56) PRF1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL5760473 0.74 CYP2E1 (0.54) PRF1HSD17B1HSD17B2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130065897-A1 COMPOUNDS, PREPARATION AND USES THEREOF PETER MACCALLUM CANCER INSTITUTE (AU) 2013-03-14 US disclosed
EP-2515903-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF Peter MacCallum Cancer Institute (AU) 2012-10-31 EP disclosed
WO-2011075784-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF PETER MACCALLUM CANCER INSTITUTE (AU) 2011-06-30 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-20130065897-A1 COMPOUNDS, PREPARATION AND USES THEREOF PRF1, GZMB, SERPINB1 PRF1 1/4885ERN1 1616/4885HSD17B1 1243/4885

“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.