SCHEMBL6724482

SCHEMBL6724482

O=C(NCc1ccc(Cl)cc1)c1cn2c3c(cc(CN4CCOCC4)cc3c1=O)OCCC2

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.68
KCNH2 Q12809 7/20 0.64
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
F2 P00734 1/20 0.47
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6419447 0.96 POLA1 (0.69) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6697011 0.87 POLA1 (0.65) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6701354 0.87 POLA1 (0.65) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6702853 0.86 POLA1 (0.62) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6413905 0.86 POLA1 (0.57) POLA1KCNH2MEN1KMT2AALDH1A1
SCHEMBL7036233 0.86 POLA1 (0.65) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6700196 0.86 POLA1 (0.61) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6698313 0.86 POLA1 (0.63) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6702708 0.85 POLA1 (0.65) POLA1KCNH2MEN1KMT2AF2
SCHEMBL6702905 0.85 POLA1 (0.64) POLA1KCNH2MEN1KMT2AF2

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-20040176366-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-09 US claimed
US-20040029879-A1 Heterocycle carboxamides as antiviral agents ANDERSON DAVID JOHN (US) 2004-02-12 US claimed
US-6624159-B2 Herpes virus PHARMACIA & UPJOHN COMPANY 2003-09-23 US claimed
US-20020025959-A1 Heterocycle carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-28 US claimed
US-20040176366-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-09-09 US disclosed
US-20040029879-A1 Heterocycle carboxamides as antiviral agents ANDERSON DAVID JOHN (US) 2004-02-12 US disclosed
US-6624159-B2 Herpes virus PHARMACIA & UPJOHN COMPANY 2003-09-23 US disclosed
US-20020025959-A1 Heterocycle carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-28 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 (3 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-20040029879-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 POLA1 267/4885KCNH2 919/4885MEN1 2250/4885
US-20040176366-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, NR1H3, NR1H2 POLA1 2447/4885KCNH2 4095/4885MEN1 2651/4885
US-20020025959-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 POLA1 267/4885KCNH2 919/4885MEN1 2250/4885

“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.