SCHEMBL14150893

SCHEMBL14150893

Cc1cccc(-c2nc(=O)c3sccc3[nH]2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ CCR1 P32246 1/20 0.41
▸ CCR8 P51685 1/20 0.41
▸ TGFBR1 P36897 1/20 0.37
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PDPK1 O15530 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KRAS P01116 1/20 0.34
▸ DGAT2 Q96PD7 1/20 0.34
▸ GAA P10253 2/20 0.33
▸ MGAM O43451 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ CBFB Q13951 1/20 0.33
▸ QPCT Q16769 1/20 0.33
▸ MEN1 O00255 1/20 0.33

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
SCHEMBL18997467 0.79 KRAS (0.56) RAB9ASMN1; SMN2METAP2KMT2AKRAS
SCHEMBL2408228 0.78 SMN1; SMN2 (0.60) ADORA2AADORA1CCR1CCR8TGFBR1
SCHEMBL14151393 0.74 CCR1 (0.40) ADORA2AADORA1CCR1CCR8TGFBR1
SCHEMBL6034500 0.73 KMT2A (0.54) RAB9ASMN1; SMN2PDPK1KMT2AGAA
SCHEMBL11570157 0.68 NPC1 (0.60) ADORA2AADORA1CCR1CCR8RAB9A
SCHEMBL15131529 0.68 CCR1 (0.50) CCR1CCR8TGFBR1CYP2A6METAP2
SCHEMBL29484635 0.68 NPC1 (0.60) ADORA2AADORA1CCR1CCR8RAB9A
SCHEMBL20665458 0.68 CCR1 (0.33) CCR1CCR8
SCHEMBL2128866 0.68 CYP2A6 (0.42) CCR1CCR8TGFBR1CYP2A6METAP2
SCHEMBL19002859 0.67 PDPK1 (0.43) PDPK1KMT2AMEN1BLM

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-20120316184-A1 NOVEL MICROBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-12-13 — — US claimed
US-20120316184-A1 NOVEL MICROBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-12-13 — — 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 (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-20120316184-A1 NOVEL MICROBICIDES NOX1, MSR1, FPR1 ADORA2A 1826/4885ADORA1 1044/4885CCR1 81/4885

“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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