SCHEMBL6754285

SCHEMBL6754285

Nc1ccc(NCc2ccccn2)nc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.64
MAOB P27338 3/20 0.64
NPC1 O15118 3/20 0.62
RAB9A P51151 2/20 0.62
KDM4E B2RXH2 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
TP53 P04637 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
HSD17B10 Q99714 1/20 0.55
PRMT1 Q99873 1/20 0.49
CYP1A2 P05177 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FYN P06241 1/20 0.46
CXCR4 P61073 1/20 0.46
FABP1 P07148 1/20 0.45
FABP6 P51161 1/20 0.45
HRH1 P35367 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44

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
SCHEMBL6677526 0.84 CYP1A2 (0.69) MAOAMAOBNPC1RAB9ACYP1A2
SCHEMBL7118813 0.81 MAOA (0.65) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL30487250 0.81 CXCR4 (0.68) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL229311 0.81 CXCR4 (0.68) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL23938004 0.81 NPC1 (0.62) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL1108639 0.81 NPC1 (0.62) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL7231916 0.78 FABP1 (0.58) KDM4ESMN1; SMN2TP53HPGDFYN
SCHEMBL20837976 0.78 MAOA (1.00) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL13757445 0.77 NPC1 (0.74) MAOAMAOBNPC1RAB9AKDM4E
SCHEMBL27304831 0.77 NPC1 (0.58) MAOAMAOBNPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020033707-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2020-02-13 WO disclosed
WO-2019032863-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2019-02-14 WO disclosed
US-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 MAOA 1183/4885MAOB 1077/4885NPC1 2667/4885

“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.