SCHEMBL15072097

SCHEMBL15072097

N[C@@H]1C[C@H]1c1cc(F)c(F)cc1F

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 18/20 0.70
KDM1B Q8NB78 11/20 0.70
KCNH2 Q12809 2/20 0.70
DPP4 P27487 1/20 0.51
FAP Q12884 1/20 0.51
DPP8 Q6V1X1 1/20 0.51
DPP9 Q86TI2 1/20 0.51
DPP7 Q9UHL4 1/20 0.51

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
SCHEMBL15906353 0.86 DPP4 (0.56) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL8239356 0.86 DPP4 (0.56) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL12354272 0.79 KDM1A (0.47) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL8272637 0.79 KDM1A (0.47) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL4562700 0.79 KDM1A (0.47) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL29941500 0.77 CHRNB2 (0.47) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL470620 0.77 CHRNB2 (0.47) KDM1AKDM1BKCNH2DPP4FAP
SCHEMBL15597453 0.76 KDM1A (0.71) KDM1AKDM1BKCNH2
SCHEMBL8226525 0.70 DPP4 (0.50) KCNH2DPP4FAPDPP8DPP7
SCHEMBL25004852 0.70 KDM1A (0.39) KDM1AKDM1BKCNH2DPP4FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165696-A1 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR ACTAVIS GROUP PTC EHF (IS) 2013-06-27 US disclosed
US-20130165696-A1 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR ACTAVIS GROUP PTC EHF (IS) 2013-06-27 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-20130165696-A1 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR THPO, P2RY4, TBXA2R KDM1A 3290/4885KDM1B 3834/4885KCNH2 2235/4885

“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.