SCHEMBL6662857

SCHEMBL6662857

CSc1nc2ccc(Cl)cc2s1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.75
NPSR1 Q6W5P4 1/20 0.75
KEAP1 Q14145 1/20 0.65
PPARA Q07869 1/20 0.58
PKM P14618 2/20 0.56
F2RL3 Q96RI0 1/20 0.54
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
ALDH1A1 P00352 5/20 0.51
MAPT P10636 5/20 0.51
NPC1 O15118 5/20 0.51
RAB9A P51151 4/20 0.51
LMNA P02545 3/20 0.51
KDM4E B2RXH2 3/20 0.51
HTT P42858 2/20 0.51
GAA P10253 1/20 0.51
ALOX12 P18054 1/20 0.51
HPGD P15428 2/20 0.51
DYRK1A Q13627 1/20 0.49
FSCN1 Q16658 1/20 0.49

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
SCHEMBL30602946 0.86 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1KEAP1PPARA
SCHEMBL1748171 0.86 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1KEAP1PPARA
SCHEMBL31214029 0.85 FBP1 (0.58) SMN1; SMN2NPSR1KEAP1PPARAF2RL3
SCHEMBL25386895 0.82 FBP1 (0.55) SMN1; SMN2NPSR1KEAP1PPARAF2RL3
SCHEMBL7867881 0.80 KEAP1 (0.67) SMN1; SMN2NPSR1KEAP1PKMF2RL3
SCHEMBL30602949 0.80 KEAP1 (0.67) SMN1; SMN2NPSR1KEAP1PKMF2RL3
SCHEMBL1622148 0.79 KEAP1 (0.65) SMN1; SMN2NPSR1KEAP1PPARAPKM
SCHEMBL14327113 0.79 KEAP1 (0.65) SMN1; SMN2NPSR1KEAP1PKMMEN1
SCHEMBL304698 0.79 KEAP1 (1.00) SMN1; SMN2NPSR1KEAP1PKMMEN1
SCHEMBL1095273 0.79 KEAP1 (0.65) SMN1; SMN2NPSR1KEAP1PKMMEN1

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
CN-116926578-A Method for synthesizing heteroaryl thiophenol 新疆大学 2023-10-24 CN disclosed
US-10189830-B2 Alkyl-heteroaryl substituted quinone derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2019-01-29 US disclosed
WO-2004010761-A2 PESTICIDAL CYANINE DYE DERIVATIVES FMC CORPORATION (US) 2004-02-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10189830-B2 Alkyl-heteroaryl substituted quinone derivatives for treatment of oxidative stress disorders NQO1, COQ8A, NDUFAB1 SMN1; SMN2 303/4885NPSR1 3338/4885KEAP1 63/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.