SCHEMBL7664784

SCHEMBL7664784

Cn1c(-c2cc3nccc(Cl)c3s2)cnc1C(=O)Nc1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
KMT2A Q03164 2/20 0.42
ABCB11 O95342 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.39
GRM5 P41594 4/20 0.39
TP53 P04637 3/20 0.39
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALOX15 P16050 1/20 0.39
KCNMA1 Q12791 1/20 0.39
RIPK1 Q13546 1/20 0.39
EGFR P00533 1/20 0.38
SRC P12931 1/20 0.38
MITF O75030 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38

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
SCHEMBL7663028 0.86 KDR (0.35) NPC1RAB9AKMT2AALDH1A1KDM4E
SCHEMBL7664800 0.83 PDE4B (0.38) NPC1RAB9A
SCHEMBL7673585 0.82 STK17B (0.34)
SCHEMBL7673416 0.82 MAP4K4 (0.37)
SCHEMBL7673525 0.81 RAB9A (0.33) NPC1RAB9AKMT2AALDH1A1ALOX15
SCHEMBL7670074 0.80 ALDH1A1 (0.40) KMT2AALDH1A1L3MBTL1MEN1
SCHEMBL7673254 0.80 LOXL2 (0.36) EGFRSRC
SCHEMBL7665356 0.80 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1NPSR1KDM4ETSHR
SCHEMBL7669525 0.79 PDE4B (0.36) NPC1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL7665579 0.79 EGFR (0.51) NPC1RAB9AKMT2AALDH1A1EGFR

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 NPC1 710/4885RAB9A 1277/4885KMT2A 2540/4885

“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.