SCHEMBL28847652

SCHEMBL28847652

CC(O)c1ccc(C(=O)c2ccc(C(C)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.50
▸ LMNA P02545 4/20 0.50
▸ ELANE P08246 2/20 0.47
▸ NOS3 P29474 1/20 0.47
▸ NOS1 P29475 1/20 0.47
▸ MAPT P10636 4/20 0.46
▸ HPGD P15428 4/20 0.46
▸ SRD5A2 P31213 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ ESR1 P03372 1/20 0.46
▸ ESR2 Q92731 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ ALPG P10696 1/20 0.42
▸ PTGS1 P23219 2/20 0.41
▸ CXCR1 P25024 2/20 0.41
▸ CXCR2 P25025 2/20 0.41
▸ PTGS2 P35354 2/20 0.41

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
SCHEMBL28587552 0.91 ALDH1A1 (0.58) ALDH1A1LMNAELANEMAPTHPGD
SCHEMBL17319344 0.83 MAPT (0.48) ALDH1A1LMNANOS3NOS1MAPT
SCHEMBL891852 0.83 TSHR (0.57) ALDH1A1HPGDSRD5A2SMN1; SMN2
SCHEMBL2669716 0.83 CYP2C9 (0.44) ALDH1A1LMNANOS3NOS1HTT
SCHEMBL6911963 0.83 TSHR (0.57) ALDH1A1HPGDSRD5A2SMN1; SMN2
SCHEMBL6912492 0.83 TSHR (0.57) ALDH1A1HPGDSRD5A2SMN1; SMN2
SCHEMBL1262317 0.83 MAPT (0.48) ALDH1A1LMNANOS3NOS1MAPT
SCHEMBL1148332 0.82 CNR1 (0.58) ALDH1A1LMNAELANEMAPTHPGD
SCHEMBL2422833 0.81 PARP10 (0.53) ALDH1A1NOS3NOS1MAPTHTT
SCHEMBL12600654 0.81 PARP10 (0.53) ALDH1A1NOS3NOS1MAPTHTT

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
CN-114089599-A Metal nanoparticle-based photoresist composition and application thereof 中国科学院理化技术研究所 2022-02-25 — — CN claimed
CN-114089599-A Metal nanoparticle-based photoresist composition and application thereof 中国科学院理化技术研究所 2022-02-25 — — CN disclosed
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