SCHEMBL29601403

SCHEMBL29601403

Cc1cc(-c2ccccc2)c(O)c(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
METAP2 P50579 1/20 0.40
KMT2A Q03164 3/20 0.39
HSD17B10 Q99714 3/20 0.39
KDM4E B2RXH2 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 2/20 0.37
CYP2C19 P33261 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ESR2 Q92731 1/20 0.37
HTT P42858 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
RCE1 Q9Y256 1/20 0.36
BACE1 P56817 2/20 0.36
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL27871869 1.00 ALDH1A1 (0.41) ALDH1A1METAP2KMT2AHSD17B10KDM4E
SCHEMBL28621461 0.81 F2 (0.32) ALDH1A1METAP2KMT2ALMNAGAA
SCHEMBL30423498 0.80 F2 (0.32) ALDH1A1METAP2LMNAGAAF2
SCHEMBL12938537 0.79 PDE4B (0.39) ALDH1A1METAP2KMT2AHSD17B10KDM4E
SCHEMBL24760377 0.79 LMNA (0.43) ALDH1A1KMT2AHSD17B10KDM4ELMNA
SCHEMBL14853069 0.79 ALDH1A1 (0.33) ALDH1A1HSD17B10KDM4EL3MBTL1ATM
SCHEMBL14460487 0.79 LMNA (0.35) ALDH1A1KMT2AHSD17B10KDM4EL3MBTL1
SCHEMBL13044876 0.78 ALDH1A1 (0.39) ALDH1A1KMT2AHSD17B10KDM4EL3MBTL1
SCHEMBL13044891 0.78 CYP1A2 (0.35) ALDH1A1KMT2AHSD17B10KDM4EL3MBTL1
SCHEMBL22320338 0.78 TUBB4A (0.37) ALDH1A1HSD17B10KDM4ELMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312772-A1 Multidentate Lewis Base Catalysts and Methods for use Thereof EXXONMOBIL CHEMICAL PATENTS INC (US) 2023-10-05 US disclosed
EP-4232484-A1 MULTIDENTATE LEWIS BASE CATALYSTS AND METHODS FOR USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-08-30 EP disclosed
WO-2022087121-A1 MULTIDENTATE LEWIS BASE CATALYSTS AND METHODS FOR USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-04-28 WO disclosed