SCHEMBL6503623

SCHEMBL6503623

Cc1ccc(-c2c(C)cccc2C(=O)Nc2ccc(N(CCc3cscn3)C(=O)O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTTP P55157 5/20 0.40
APOB P04114 2/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
KDM4E B2RXH2 2/20 0.39
TRPV1 Q8NER1 1/20 0.38
ROCK2 O75116 1/20 0.38
LIMK1 P53667 1/20 0.38
ROCK1 Q13464 1/20 0.38
SMO Q99835 5/20 0.37
STAT1 P42224 1/20 0.37
NR3C1 P04150 1/20 0.37
PLAU P00749 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA2A P29274 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL6792786 0.88 KMT2A (0.44) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL6501858 0.85 GCGR (0.43) NPC1RAB9AKDM4EROCK2LIMK1
SCHEMBL6491092 0.84 CYP3A4 (0.38) NPC1RAB9AKDM4EROCK2LIMK1
SCHEMBL6492713 0.84 MTTP (0.41) MTTPAPOBNPC1RAB9ACASP3
SCHEMBL6501137 0.80 PDE5A (0.39) MTTPAPOBNPC1RAB9AKDM4E
SCHEMBL6792292 0.79 ALDH1A1 (0.41) NPC1RAB9ALIMK1
SCHEMBL6796239 0.79 GAA (0.55) NPC1RAB9AKDM4ECYP3A4
SCHEMBL6498587 0.78 APOB (0.44) MTTPAPOBNPC1RAB9AKDM4E
SCHEMBL6501450 0.76 NPC1 (0.43) MTTPAPOBNPC1RAB9AKDM4E
SCHEMBL6489780 0.75 PDE5A (0.38) MTTPAPOBNPC1RAB9AKDM4E

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 MTTP 677/4885APOB 1/4885NPC1 100/4885

“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.