SCHEMBL25223533

SCHEMBL25223533

COc1ccc(C=CC(=O)c2ccc(O)cc2)cc1COc1cc(C)ccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.60
▸ LMNA P02545 7/20 0.60
▸ MEN1 O00255 6/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ KDM4E B2RXH2 2/20 0.60
▸ MAPT P10636 7/20 0.58
▸ NPSR1 Q6W5P4 3/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ CYP1A2 P05177 1/20 0.57
▸ CYP2D6 P10635 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ HPGD P15428 1/20 0.55
▸ THRB P10828 1/20 0.54
▸ CTSL P07711 1/20 0.52
▸ MITF O75030 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ RAB9A P51151 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
SCHEMBL25284637 1.00 ALDH1A1 (0.60) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25191667 0.94 ALDH1A1 (0.67) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25200540 0.90 KMT2A (0.70) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL30384262 0.90 KMT2A (0.70) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25243967 0.89 ALDH1A1 (0.65) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25196675 0.88 CYP19A1 (0.58) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL25193881 0.87 ALDH1A1 (0.68) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25202171 0.86 MEN1 (0.67) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL30383487 0.86 MEN1 (0.67) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL25209839 0.85 MEN1 (0.66) ALDH1A1LMNAMEN1KMT2AKDM4E

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-4429763-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS Yewsavin, Inc. (US) 2024-09-18 — — EP disclosed
WO-2023086388-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2023-05-19 — — WO disclosed
Send feedback