SCHEMBL6667353

SCHEMBL6667353

O=C(NCc1ccc(Cl)cc1)c1cn(CCSc2ccccc2)c2ccc(CN3CCOCC3)cc2c1=O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.57
KCNH2 Q12809 7/20 0.56
F2 P00734 1/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MAPT P10636 3/20 0.49
ALDH1A1 P00352 1/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
ENPP2 Q13822 1/20 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
SCHEMBL6668294 0.96 POLA1 (0.59) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6667644 0.93 F2 (0.57) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6668377 0.89 F2 (0.59) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6697165 0.88 F2 (0.60) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6670482 0.86 KCNH2 (0.59) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6694680 0.86 POLA1 (0.60) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6698352 0.85 F2 (0.62) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6668954 0.85 KCNH2 (0.57) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6693197 0.84 KCNH2 (0.59) POLA1KCNH2F2MEN1KMT2A
SCHEMBL6697748 0.84 KCNH2 (0.58) POLA1KCNH2F2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US claimed
WO-2004019932-A1 METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS PHARMACIA & UPJOHN COMPANY (US) 2004-03-11 WO claimed
US-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US claimed
US-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-23 US disclosed
WO-2004019932-A1 METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS PHARMACIA & UPJOHN COMPANY (US) 2004-03-11 WO disclosed
US-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 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-20040186131-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, NR1H3, NR1H2 POLA1 2550/4885KCNH2 4383/4885F2 555/4885

“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.