SCHEMBL12786983

SCHEMBL12786983

Cc1cc2c(Cl)ccnc2cc1-c1csc(C=O)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 2/20 0.47
▸ LCK P06239 1/20 0.47
▸ MAPK14 Q16539 1/20 0.47
▸ TLR8 Q9NR97 1/20 0.32
▸ CCR6 P51684 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ ABL1 P00519 1/20 0.31
▸ SCN9A Q15858 2/20 0.31
▸ EIF4E P06730 1/20 0.31
▸ CYP19A1 P11511 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL12786977 0.80 FBP1 (0.36) TLR8MEN1KMT2AATMCYP19A1
SCHEMBL12786978 0.71 RET (0.55) RETLCKSMN1; SMN2
SCHEMBL6002911 0.69 TLR8 (0.43) TLR8MEN1KMT2AMAPT
SCHEMBL3193066 0.68 CYP19A1 (0.53) SMN1; SMN2KMT2ACYP19A1MAPT
SCHEMBL15010413 0.66 SCN9A (0.36) TLR8KMT2ASCN9A
SCHEMBL5522989 0.64 TLR8 (0.39) TLR8SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL30993822 0.64 TLR8 (0.39) TLR8MEN1KMT2AMAPT
SCHEMBL12786975 0.64 TLR8 (0.39) TLR8MEN1KMT2AMAPT
SCHEMBL15960732 0.64 TLR8 (0.52) RETTLR8CCR6SMN1; SMN2MEN1
SCHEMBL12663393 0.64 MAPT (0.36) TLR8SMN1; SMN2MEN1KMT2AMAPT

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
US-20110053934-A1 COMPOUNDS AND METHODS OF TREATMENT GLAXOSMITHKLINE LLC (US) 2011-03-03 — — US disclosed
US-20080234267-A1 Compounds and Methods of Treatment SMITHKLINE BEECHAM CORPORATION 2008-09-25 — — US 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 (2 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-20110053934-A1 COMPOUNDS AND METHODS OF TREATMENT RET, ABL1, PRKACA RET 1/4885LCK 89/4885MAPK14 457/4885
US-20080234267-A1 Compounds and Methods of Treatment RET, ABL1, PRKACA RET 1/4885LCK 89/4885MAPK14 457/4885

“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.

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