SCHEMBL6929774

SCHEMBL6929774

Clc1cccc(Nc2nc3c(NCCc4ccccn4)ccc(Cl)c3o2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.51
LMNA P02545 2/20 0.46
PKM P14618 1/20 0.45
RAB9A P51151 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
CYP1A2 P05177 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.38
HSD11B1 P28845 1/20 0.38
KMT2A Q03164 1/20 0.37
APP P05067 2/20 0.36
PIM1 P11309 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
SCHEMBL6931979 0.69 F2 (0.58) F2LMNARAB9AKDM4ENPC1
SCHEMBL6929352 0.67 F2 (0.77) F2
SCHEMBL6794552 0.66 PKM (0.55) LMNAPKMRAB9AKDM4ENPC1
SCHEMBL5839592 0.65 CDK1 (0.74) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL3952305 0.65 MAOA (0.67) LMNARAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL6931474 0.64 F2 (0.86) F2LMNARAB9AKDM4ENPC1
SCHEMBL18292385 0.64 LMNA (1.00) LMNARAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL3948210 0.63 KDM4E (0.53) F2LMNARAB9AKDM4ENPC1
SCHEMBL9093601 0.63 CYP1A2 (0.69) LMNAPKMRAB9AKDM4ENPC1
SCHEMBL31705591 0.63 CYP1A2 (0.68) LMNARAB9ANPC1SMN1; SMN2ALDH1A1

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
US-20030225131-A1 Thrombin inhibitors BURGEY CHRISTOPHER S (US) 2003-12-04 US claimed
US-20030225131-A1 Thrombin inhibitors BURGEY CHRISTOPHER S (US) 2003-12-04 US disclosed
US-20030225131-A1 Thrombin inhibitors BURGEY CHRISTOPHER S (US) 2003-12-04 US disclosed
US-20030225131-A1 Thrombin inhibitors BURGEY CHRISTOPHER S (US) 2003-12-04 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-20030225131-A1 Thrombin inhibitors TFPI, SERPINC1, PLAT F2 5/4885LMNA 4157/4885PKM 4819/4885

“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.