SCHEMBL6499502

SCHEMBL6499502

Cc1ccc(C2=C(C(=O)Nc3ccc(NCCc4csc(N)n4)nc3)CCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.40
TP53 P04637 4/20 0.38
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
MAPK14 Q16539 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DGAT1 O75907 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
SCHEMBL6497226 0.93 TP53 (0.40) KDM1ATP53ALDH1A1SMN1; SMN2RAB9A
SCHEMBL6492282 0.90 NPC1 (0.41) KDM1ATP53ALDH1A1SMN1; SMN2RAB9A
SCHEMBL6488453 0.90 TP53 (0.42) TP53SMN1; SMN2MAPTLMNAKDM4E
SCHEMBL6491525 0.86 ALDH1A1 (0.38) TP53ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6502051 0.85 SMN1; SMN2 (0.45) TP53ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6491345 0.83 CYP1A2 (0.44) TP53ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6491900 0.82 SMN1; SMN2 (0.58) TP53ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6502201 0.82 TP53 (0.47) TP53ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6489500 0.79 TP53 (0.49) TP53SMN1; SMN2MAPTLMNAKDM4E
SCHEMBL6490167 0.78 DGAT1 (0.35) TP53ALDH1A1SMN1; SMN2RAB9ANPC1

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 KDM1A 470/4885TP53 3031/4885ALDH1A1 1603/4885

“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.