SCHEMBL16015977

SCHEMBL16015977

CCOC(=O)[C@H](C)N[P@](=O)(Oc1ccccc1)Oc1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 8/20 0.49
▸ ELANE P08246 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL16258622 1.00 BTN3A1 (0.49) BTN3A1ELANEHPGDALDH1A1MEN1
SCHEMBL16258628 0.95 BTN3A1 (0.45) BTN3A1ELANEHPGDALDH1A1MEN1
SCHEMBL15343937 0.95 MEN1 (0.46) BTN3A1HPGDALDH1A1MEN1KMT2A
SCHEMBL15343939 0.95 MEN1 (0.46) BTN3A1HPGDALDH1A1MEN1KMT2A
SCHEMBL16575733 0.90 BTN3A1 (0.44) BTN3A1ELANEHPGDALDH1A1TSHR
SCHEMBL16258631 0.89 MEN1 (0.42) BTN3A1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL16258629 0.89 MEN1 (0.42) BTN3A1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL30583779 0.89 MEN1 (0.42) BTN3A1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL22065039 0.89 BTN3A1 (0.51) BTN3A1ELANEALDH1A1
SCHEMBL28986476 0.87 BTN3A1 (0.41) BTN3A1ELANEHPGDALDH1A1TSHR

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-2805960-A1 Methods for the preparation of diasteromerically pure phosphoramidate prodrugs GILEAD SCIENCES, INC. (US) 2014-11-26 — — EP disclosed
EP-2596004-B1 METHODS FOR THE PREPARATION OF DIASTEROMERICALLY PURE PHOSPHORAMIDATE PRODRUGS GILEAD SCIENCES INC (US) 2014-09-10 — — EP disclosed
Send feedback