Benzaldehyde

Benzaldehyde

SCHEMBL29064698

COc1cccc2c1[nH]c1ccccc12.O=Cc1ccccc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
ATM Q13315 4/20 0.53
ALDH1A1 P00352 3/20 0.50
NQO2 P16083 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
KDM4E B2RXH2 5/20 0.47
MAPT P10636 5/20 0.47
HPGD P15428 2/20 0.47
POLB P06746 2/20 0.47
MCL1 Q07820 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPK1 P28482 2/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 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
SCHEMBL896249 0.86 KDM4E (0.58) MEN1KMT2AATMALDH1A1NQO2
SCHEMBL29446056 0.86 KDM4E (0.58) MEN1KMT2AATMALDH1A1NQO2
SCHEMBL31188795 0.83 KIF11 (0.56) MEN1KMT2AATMALDH1A1NQO2
SCHEMBL29655432 0.83 KIF11 (0.56) MEN1KMT2AATMALDH1A1NQO2
SCHEMBL28302649 0.81 MEN1 (0.58) MEN1KMT2AATMALDH1A1ABCG2
Murrayanine SCHEMBL3087481 0.81 KIF11 (0.54) MEN1KMT2AATMALDH1A1NQO2
Phosphoric Acid SCHEMBL29126247 0.81 ABCG2 (0.51) MEN1KMT2AATMALDH1A1NQO2
Oxirane SCHEMBL28742426 0.79 KDM4E (0.51) MEN1KMT2AATMALDH1A1NQO2
Benzaldehyde SCHEMBL28711272 0.78 KIF11 (0.49) MEN1KMT2AATMALDH1A1KDM4E
Carbazole SCHEMBL27911539 0.78 KIF11 (0.69) MEN1KMT2AATMALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116528598-A Perovskite laminated cell 上海辉纳思光电科技有限公司 2023-08-01 CN disclosed