SCHEMBL25840260

SCHEMBL25840260

O=C(CC(=O)N1CCCCC1)Cc1cc(F)c(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.44
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.40
DPP8 Q6V1X1 2/20 0.39
DPP9 Q86TI2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39

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
SCHEMBL28435927 0.98 DPP4 (0.45) DPP4MAPTKMT2ADPP8
SCHEMBL21565035 0.85 KDM4E (0.48) DPP4MAPTKMT2ARAB9A
SCHEMBL21565165 0.85 DPP4 (0.53) DPP4DPP8DPP7
SCHEMBL21985096 0.85 DPP4 (0.51) DPP4MAPTKMT2A
SCHEMBL28424221 0.80 DPP4 (0.40) DPP4DPP8DPP7
SCHEMBL28424229 0.79 OPRK1 (0.39) DPP4RAB9A
SCHEMBL21565049 0.77 KDM4E (0.36) DPP4DPP8DPP9DPP7
SCHEMBL29196914 0.77 DPP4 (0.55) DPP4KMT2ADPP8DPP7
SCHEMBL24725614 0.76 ATM (0.50) DPP4KMT2AHPGDRAB9A
SCHEMBL28440209 0.74 ATM (0.52) DPP4

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
EP-4050102-B1 TRANSAMINASE MUTANT AND USE THEREOF IN PREPARATION OF SITAGLIPTIN INTERMEDIATE ZHEJIANG YONGTAI TECHNOLOGY CO LTD (CN) 2026-03-11 EP claimed
US-20230203550-A1 USE OF STEREOSELECTIVE TRANSAMINASE IN ASYMMETRIC SYNTHESIS OF CHIRAL AMINE ABIOCHEM BIOTECHNOLOGY CO., LTD (CN) 2023-06-29 US disclosed