SCHEMBL5698188

SCHEMBL5698188

C=C(CO)C(=O)NCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 2/20 0.54
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 3/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 1/20 0.53
LMNA P02545 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 2/20 0.50
PLIN1 O60240 1/20 0.50
PLIN5 Q00G26 1/20 0.50
ABHD5 Q8WTS1 1/20 0.50
HPGD P15428 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47

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
SCHEMBL5175379 0.85 TXNRD1 (0.54) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL553682 0.84 TXNRD1 (0.56) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL1269639 0.84 CYP1A2 (0.56) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL24584925 0.84 TXNRD1 (0.52) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL9403358 0.84 GAA (0.58) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL24323271 0.84 ALDH1A1 (0.56) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL8517079 0.82 ALDH1A1 (0.58) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL24584923 0.82 TXNRD1 (0.51) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL5176555 0.82 TXNRD1 (0.51) TXNRD1KMT2AALDH1A1MEN1MAPT
SCHEMBL3056874 0.82 KMT2A (0.71) KMT2AALDH1A1MEN1MAPTLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022137240-A1 METHACRYLAMIDES PROTEIN BINDERS AND USES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2022-06-30 WO disclosed
EP-0933682-B1 Radiation-sensitive compositions with binders of polymers comprising N-substituted maleimide units AGFA GEVAERT (BE) 2006-08-09 EP disclosed
US-6190825-B1 N-(P-AMINOSULFONYL)PHENYL-SUBSTITUTED AGFA-GEVAERT N.V. (BE) 2001-02-20 US disclosed
EP-0933682-A2 Polymers comprising N-substituted maleimide units and their use in radiation-sensitive compositions Agfa-Gevaert AG (DE) 1999-08-04 EP disclosed