SCHEMBL7673775

SCHEMBL7673775

CC(NC(=O)c1ncc(-c2cc3nccc(Cl)c3s2)n1C)c1cccnc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.42
ADORA2A P29274 8/20 0.40
ADORA2B P29275 5/20 0.40
ROCK2 O75116 1/20 0.36
PDPK1 O15530 1/20 0.36
KCNA5 P22460 1/20 0.35
TP53 P04637 1/20 0.35
ADORA3 P0DMS8 3/20 0.35
ADORA1 P30542 1/20 0.35
KIT P10721 2/20 0.34
TBXA2R P21731 1/20 0.34
PTGER1 P34995 1/20 0.34
DYRK3 O43781 1/20 0.34
PRKCG P05129 1/20 0.34
PRKACA P17612 1/20 0.34
RPS6KB1 P23443 1/20 0.34
MAPK1 P28482 1/20 0.34
CLK2 P49760 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34

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
SCHEMBL7670074 0.92 ALDH1A1 (0.40) CHRM4ADORA2BROCK2KITDYRK3
SCHEMBL7663028 0.81 KDR (0.35) CLK2
SCHEMBL7671995 0.80 EGFR (0.49) CHRM4ADORA2AADORA2BROCK2
SCHEMBL7664784 0.78 NPC1 (0.42) TP53
SCHEMBL7673416 0.78 MAP4K4 (0.37) STK17A
SCHEMBL7673585 0.78 STK17B (0.34)
SCHEMBL7665356 0.77 SMN1; SMN2 (0.38) PTGER1MAPK1GSK3B
SCHEMBL7673525 0.77 RAB9A (0.33)
SCHEMBL7673779 0.75 CLK1 (0.41) TP53MAPK1
SCHEMBL7673254 0.75 LOXL2 (0.36) ADORA2AROCK2PDPK1KITRPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020004511-A1 Thiophene derivatives useful as anticancer agents LUZZIO MICHAEL JOSEPH (US) 2002-01-10 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-20020004511-A1 Thiophene derivatives useful as anticancer agents CCNA1, CCNE1, TP53 CHRM4 4708/4885ADORA2A 3090/4885ADORA2B 3682/4885

“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.