SCHEMBL5828133

SCHEMBL5828133

O=C1NC(c2ccc3cc(-c4ccc(O)c(C56CC7CC(CC(C7)C5)C6)c4)ccc3c2)C(=O)S1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.56
RARG P13631 9/20 0.56
RARA P10276 7/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56
ALOX15 P16050 1/20 0.56
ALOX12 P18054 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
THRB P10828 1/20 0.47
RECQL P46063 1/20 0.47
NR2E1 Q9Y466 1/20 0.47
PTPN11 Q06124 3/20 0.46

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
SCHEMBL5828062 0.85 RARB (0.58) RARBRARGRARAMEN1KMT2A
SCHEMBL5828131 0.83 RARB (0.58) RARBRARGRARAMEN1KMT2A
SCHEMBL5827650 0.78 RARB (0.53) RARBRARGRARAMEN1KMT2A
SCHEMBL5827559 0.76 PTPN11 (0.74) RARBRARGRARAMEN1KMT2A
SCHEMBL5827560 0.76 PTPN11 (0.74) RARBRARGRARAMEN1KMT2A
SCHEMBL6454889 0.75 RARB (0.70) RARBRARGRARAMEN1KMT2A
SCHEMBL5827651 0.74 RARB (0.53) RARBRARGRARAMEN1KMT2A
SCHEMBL26052718 0.74 RARB (0.80) RARBRARGRARAMEN1KMT2A
O-Demethylated Adapalene SCHEMBL29357074 0.72 RARG (1.00) RARBRARGRARAMEN1KMT2A
O-Demethylated Adapalene SCHEMBL29727107 0.72 RARG (1.00) RARBRARGRARAMEN1KMT2A

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-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 US claimed
US-7153875-B2 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE SAN DIEGO (US) 2006-12-26 US disclosed
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 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-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases CCNY, HRAS, AHR RARB 1465/4885RARG 1374/4885RARA 1460/4885

“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.