SCHEMBL2277153

SCHEMBL2277153

O=C(O)c1cccc(Cc2ccc3ccn(-c4cccc(C(=O)O)c4)c3c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.51
F10 P00742 2/20 0.51
PRSS1 P07477 2/20 0.51
FOLH1 Q04609 1/20 0.48
POLB P06746 5/20 0.46
MAPT P10636 5/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
RECQL P46063 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
HSD17B10 Q99714 3/20 0.46
APEX1 P27695 2/20 0.46
NR4A1 P22736 2/20 0.46
PTPN7 P35236 2/20 0.46
NSD2 O96028 1/20 0.46
MAPK1 P28482 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
KDM4E B2RXH2 4/20 0.43

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
SCHEMBL2278773 0.90 MRGPRX4 (0.52) F2F10PRSS1L3MBTL1TDP1
SCHEMBL1356949 0.82 PLA2G10 (0.54) POLBMAPTL3MBTL1RECQLTDP1
SCHEMBL12403338 0.81 CA1 (0.47) FOLH1CA1CA2CA9KMT2A
SCHEMBL2273602 0.80 PLG (0.49) FOLH1POLBCA1CA2CA9
SCHEMBL12373314 0.78 CA1 (0.44) FOLH1CA1CA2CA9ALDH1A1
SCHEMBL24950460 0.77 FGFR1 (0.55) F2F10PRSS1L3MBTL1HSD17B10
SCHEMBL30201454 0.77 FGFR1 (0.55) F2F10PRSS1L3MBTL1HSD17B10
SCHEMBL30791058 0.76 FOLH1 (0.70) PRSS1FOLH1CA1CA2CA9
SCHEMBL70351 0.76 FOLH1 (0.70) PRSS1FOLH1CA1CA2CA9
SCHEMBL12491602 0.75 SETD7 (0.63) F2F10PRSS1MAPK1KDM4E

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-8455516-B2 HIV-1 fusion inhibitors and methods TOURO UNIVERSITY (US) 2013-06-04 US claimed
US-20110190343-A1 HIV-1 FUSION INHIBITORS AND METHODS TOURO UNIVERSITY (US) 2011-08-04 US claimed
US-8455516-B2 HIV-1 fusion inhibitors and methods TOURO UNIVERSITY (US) 2013-06-04 US disclosed
US-20110190343-A1 HIV-1 FUSION INHIBITORS AND METHODS TOURO UNIVERSITY (US) 2011-08-04 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-20110190343-A1 HIV-1 FUSION INHIBITORS AND METHODS FLI1, API5, MAVS F2 2743/4885F10 1187/4885PRSS1 1133/4885

“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.