SCHEMBL1454615

SCHEMBL1454615

Cc1nnc(NC(=O)c2ccc(Sc3ccc(NC(=O)OCC(Cl)(Cl)Cl)cc3)c(N)c2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
SMN1; SMN2 Q16637 7/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 3/20 0.41
MAPT P10636 5/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
LMNA P02545 2/20 0.40
ALOX15 P16050 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
CYP1A2 P05177 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
SCHEMBL1455533 0.90 KDM4E (0.47) KDM4ENPC1RAB9ASMN1; SMN2TP53
SCHEMBL1456014 0.87 ALDH1A1 (0.46) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL1454516 0.85 KDM4E (0.42) KDM4ERAB9ATP53MAPTALDH1A1
SCHEMBL4973595 0.85 RAB9A (0.50) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL1455558 0.82 MAPT (0.43) KDM4ENPC1RAB9ATDP1TP53
SCHEMBL1454861 0.82 MAPT (0.46) KDM4ENPC1RAB9ASMN1; SMN2TP53
SCHEMBL1455151 0.81 MAPT (0.45) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL1455037 0.81 MAPT (0.43) KDM4ENPC1RAB9ASMN1; SMN2TP53
SCHEMBL1455784 0.81 MAPT (0.41) KDM4ENPC1RAB9ASMN1; SMN2TP53
SCHEMBL1453591 0.78 KCNQ3 (0.47) KDM4EMAPTALDH1A1HPGDLMNA

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
EP-1979348-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-01-18 EP disclosed
US-7910595-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2011-03-22 US disclosed
US-20070232627-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 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-20070232627-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 KDM4E 1822/4885NPC1 37/4885RAB9A 571/4885

“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.