SCHEMBL12677275

SCHEMBL12677275

O=Cc1ccccc1Cn1ccc(CN2CCC(Cc3ccccc3)CC2)c(O)c1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 7/20 0.57
▸ EGLN1 Q9GZT9 7/20 0.57
▸ ATM Q13315 3/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ CCR3 P51677 4/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL278211 0.87 VEGFA (0.75) VEGFAEGLN1ATMALDH1A1CCR3
SCHEMBL12598834 0.87 VEGFA (0.69) VEGFAEGLN1ATMALDH1A1CCR3
SCHEMBL12649390 0.83 MEN1 (0.58) VEGFAEGLN1CCR3MEN1KMT2A
SCHEMBL12649394 0.76 VEGFA (0.70) VEGFAEGLN1
SCHEMBL278202 0.74 VEGFA (1.00) VEGFAEGLN1ALDH1A1KMT2AKDM4E
SCHEMBL20763920 0.74 VEGFA (0.57) VEGFAEGLN1ATMALDH1A1CCR3
SCHEMBL12598832 0.73 VEGFA (0.73) VEGFAEGLN1ALDH1A1KDM4E
SCHEMBL273037 0.73 EGLN1 (0.87) VEGFAEGLN1ALDH1A1MEN1KMT2A
SCHEMBL277668 0.72 EGLN1 (0.85) VEGFAEGLN1KDM4ESMN1; SMN2
SCHEMBL273696 0.72 EGLN1 (0.85) VEGFAEGLN1KDM4ESMN1; SMN2

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-2496236-B1 PROLYL HYDROXYLASE INHIBITORS AERPIO THERAPEUTICS INC (US) 2013-05-01 — — EP disclosed
WO-2011057121-A1 COMPOSITIONS AND METHODS FOR TREATING COLITIS AKEBIA THERAPEUTICS INC. (US) 2011-05-12 — — WO disclosed
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