SCHEMBL6908110

SCHEMBL6908110

CCCNC(=O)c1ccc(-c2ccc(Cl)cc2)c(COc2ccc(-c3nc4cc(C(=O)O)ccc4n3C3CCCCC3)c(F)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
NR1H4 Q96RI1 11/20 0.41
VDR P11473 5/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2C9 P11712 3/20 0.39
KCNH2 Q12809 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CNR1 P21554 1/20 0.39
THRB P10828 1/20 0.39

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
Hydrochloric Acid SCHEMBL5515089 0.99 L3MBTL1 (0.42) L3MBTL1NR1H4VDRMAPTHPGD
SCHEMBL14383790 0.96 HPGD (0.46) L3MBTL1NR1H4VDRMAPTHPGD
Hydrochloric Acid SCHEMBL5508860 0.95 HPGD (0.45) L3MBTL1NR1H4VDRMAPTHPGD
SCHEMBL14383795 0.95 L3MBTL1 (0.44) L3MBTL1NR1H4VDRMAPTCYP2C9
SCHEMBL6703402 0.95 L3MBTL1 (0.42) L3MBTL1NR1H4VDRMAPTCYP2C9
Hydrochloric Acid SCHEMBL5516308 0.94 L3MBTL1 (0.41) L3MBTL1NR1H4VDRMAPTCYP2C9
Hydrochloric Acid SCHEMBL5514407 0.94 L3MBTL1 (0.43) L3MBTL1NR1H4VDRMAPTCYP2C9
SCHEMBL14383766 0.93 L3MBTL1 (0.43) L3MBTL1NR1H4VDRMAPTCYP2C9
SCHEMBL6699590 0.92 L3MBTL1 (0.42) L3MBTL1NR1H4VDRCYP2C9KCNH2
Hydrochloric Acid SCHEMBL5510313 0.92 L3MBTL1 (0.43) L3MBTL1NR1H4VDRMAPTCYP2C9

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-7285551-B2 Fused-ring compounds and use thereof as drugs JAPAN TOBACCO INC. (JP) 2007-10-23 US disclosed
US-7285551-B2 Fused-ring compounds and use thereof as drugs JAPAN TOBACCO INC. (JP) 2007-10-23 US disclosed
US-6770666-B2 A THERAPEUTIC AGENT FOR TREATING HEPATITIS C, BASED ON POLYMERASE INHIBITORY ACTIVITY JAPAN TOBACCO INC. (JP) 2004-08-03 US disclosed
US-20030050320-A1 Fused-ring compounds and use thereof as drugs JAPAN TOBACCO INC. (JP) 2003-03-13 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-20030050320-A1 Fused-ring compounds and use thereof as drugs HAVCR2, ZC3HAV1, HLA-C L3MBTL1 4672/4885NR1H4 37/4885VDR 3966/4885

“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.