SCHEMBL9952211

SCHEMBL9952211

Cc1ccc2cccc(OCCCCCCOc3cccc4ccc(C)nc34)c2n1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.65
LMNA P02545 2/20 0.65
HTT P42858 1/20 0.65
MCHR1 Q99705 5/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
BDKRB2 P30411 1/20 0.57
ALDH1A1 P00352 2/20 0.54
MAPT P10636 2/20 0.54
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PTGDR2 Q9Y5Y4 1/20 0.52
NCF1 P14598 3/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL28065654 0.94 MCHR1 (0.72) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL10682868 0.94 MCHR1 (0.72) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL10063463 0.90 MCHR1 (0.70) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL5884414 0.86 MCHR1 (0.74) KDM4ELMNAHTTMCHR1NCF1
SCHEMBL10029548 0.86 MEN1 (0.65) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL4137529 0.84 MEN1 (0.63) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL17788511 0.84 KDM4E (0.59) KDM4ELMNAHTTMCHR1MEN1
SCHEMBL25869080 0.83 MEN1 (0.61) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL13739123 0.81 KDM4E (0.61) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL8886414 0.80 PTGDR2 (0.60) KDM4ELMNAHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493419-B2 Quinoline derivatives as anti-cancer agents THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2016-11-15 US disclosed
US-9493419-B2 Quinoline derivatives as anti-cancer agents THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2016-11-15 US disclosed
US-9493419-B2 Quinoline derivatives as anti-cancer agents THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2016-11-15 US disclosed
US-20120165370-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2012-06-28 US disclosed
US-20120165370-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2012-06-28 US disclosed
WO-2012083866-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2012-06-28 WO disclosed
WO-2012083866-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2012-06-28 WO disclosed
US-20120165370-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2012-06-28 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-20120165370-A1 QUINOLINE DERIVATIVES AS ANTI-CANCER AGENTS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HKDC1, HK1 KDM4E 75/4885LMNA 917/4885HTT 1610/4885

“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.