SCHEMBL21594820

SCHEMBL21594820

O=C(O)C1OC(OCCc2ccccc2)C(O)C(O)C1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGF2 P09038 1/20 0.53
MAOB P27338 1/20 0.53
CES1 P23141 1/20 0.42
SYNJ2 O15056 2/20 0.42
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ABL1 P00519 1/20 0.42
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
PABPC1 P11940 1/20 0.42
RECQL P46063 1/20 0.42
GALK1 P51570 1/20 0.42
CASP7 P55210 1/20 0.42
CASP6 P55212 1/20 0.42
MCL1 Q07820 1/20 0.42
RIN1 Q13671 1/20 0.42
EIF4H Q15056 1/20 0.42

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
SCHEMBL9401184 1.00 FGF2 (0.53) FGF2MAOBCES1SYNJ2POLB
SCHEMBL25941792 0.88 FGF2 (0.50) FGF2MAOBCES1POLBGAA
SCHEMBL7155243 0.85 FGF2 (0.49) FGF2CES1SYNJ2POLBGAA
SCHEMBL3492499 0.85 FGF2 (0.49) FGF2CES1SYNJ2POLBGAA
SCHEMBL25941814 0.84 FGF2 (0.47) FGF2MAOBCES1POLBGAA
SCHEMBL7154155 0.84 FGF2 (0.47) FGF2CES1SYNJ2POLBGAA
SCHEMBL9401182 0.83 HCAR2 (0.40) FGF2MAOBALDH1A1HPGDHPSE
SCHEMBL8843011 0.78 MAOB (0.70) MAOBSYNJ2POLBGAAMAPT
SCHEMBL4453793 0.78 MAOB (0.70) MAOBSYNJ2POLBGAAMAPT
SCHEMBL8818263 0.78 MAOB (0.70) MAOBSYNJ2POLBGAAMAPT

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-20250138016-A1 METHODS FOR THE DETECTION AND TREATMENT OF OVARIAN CANCER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2025-05-01 US disclosed
US-20190391092-A1 METABOLIC PROFILING WITH MAGNETIC RESONANCE MASS SPECTROMETRY (MRMS) Oregon Institute of Science and Medicine 2019-12-26 US disclosed