SCHEMBL14136108

SCHEMBL14136108

CCCCOc1ccccc1NC(=O)c1cccnc1F

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.64
POLB P06746 1/20 0.56
TSHR P16473 1/20 0.56
KMT2A Q03164 4/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NR3C1 P04150 1/20 0.52
MEN1 O00255 2/20 0.51
MRGPRX1 Q96LB2 1/20 0.50
RXFP1 Q9HBX9 2/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.48
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HTT P42858 1/20 0.47
GPR55 Q9Y2T6 1/20 0.47
THRB P10828 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL14095615 0.82 L3MBTL1 (0.66) PTPN1L3MBTL1GAAMAPT
SCHEMBL7954014 0.81 PTPN1 (0.58) PTPN1POLBTSHRKMT2AL3MBTL1
SCHEMBL4488799 0.77 HSD17B10 (0.59) POLBKMT2AL3MBTL1MEN1HSD17B10
SCHEMBL29406212 0.77 PTPN1 (0.75) PTPN1POLBTSHRKMT2AMEN1
SCHEMBL23924441 0.77 PTPN1 (0.75) PTPN1POLBTSHRKMT2AMEN1
SCHEMBL3078899 0.76 TSHR (0.53) PTPN1TSHRKMT2AL3MBTL1MEN1
SCHEMBL7956544 0.75 KMT2A (0.72) PTPN1POLBTSHRKMT2AL3MBTL1
SCHEMBL6838359 0.75 KMT2A (0.68) PTPN1POLBTSHRKMT2AL3MBTL1
SCHEMBL23943618 0.75 KMT2A (0.68) PTPN1POLBTSHRKMT2AL3MBTL1
SCHEMBL4480002 0.74 CYP1A2 (0.64) KMT2AMEN1GAAHTTRAB9A

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-8399452-B2 Anticancer agents; antiproliferative agenst; antiprotozoa agents METHYLGENE INC. (CA) 2013-03-19 US disclosed
US-20080207590-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2008-08-28 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-20080207590-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC11 PTPN1 3867/4885POLB 694/4885TSHR 3882/4885

“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.