SCHEMBL31302973

SCHEMBL31302973

CCCCN1c2ccccc2Sc2cc([N+](=O)[O-])ccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 4/20 0.60
▸ KDM1A O60341 4/20 0.52
▸ MARK4 Q96L34 1/20 0.50
▸ SLC22A1 O15245 1/20 0.47
▸ PRNP P04156 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ ADRB2 P07550 1/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ CHRM4 P08173 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ CHRM5 P08912 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CHRM1 P11229 1/20 0.47
▸ DRD2 P14416 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ADRA2B P18089 1/20 0.47
▸ ADRA2C P18825 1/20 0.47
▸ CHRM3 P20309 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
SCHEMBL25028122 0.88 MARK4 (0.57) SNCAKDM1AMARK4SLC22A1PRNP
SCHEMBL27786833 0.84 MARK4 (0.50) SNCAKDM1AMARK4SLC22A1PRNP
SCHEMBL11725544 0.83 SNCA (0.71) SNCAMARK4ADRA2AADRA2BADRA2C
SCHEMBL30777324 0.83 SNCA (0.71) SNCAMARK4ADRA2AADRA2BADRA2C
SCHEMBL30628542 0.81 KDM1A (0.73) KDM1ASLC22A1PRNPTP53CYP1A2
SCHEMBL31302974 0.81 KDM1A (0.73) KDM1ASLC22A1PRNPTP53CYP1A2
SCHEMBL7998997 0.81 KDM1A (0.73) KDM1ASLC22A1PRNPTP53CYP1A2
SCHEMBL17356869 0.80 SNCA (0.56) SNCACYP1A2TSHRLMNAMAPT
SCHEMBL14947365 0.79 KDM1A (0.59) KDM1ASLC22A1PRNPTP53CYP1A2
Iodide SCHEMBL13735812 0.78 KDM1A (0.69) KDM1ASLC22A1PRNPTP53CYP1A2

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-119241469-A Photoinitiator, photopolymerization composition and application thereof 武汉尚赛光电科技有限公司 2025-01-03 — — CN disclosed
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