SCHEMBL19725901

SCHEMBL19725901

CCSc1ccc(-c2ccc(C)cc2)nc1-c1nc2cc(C(F)(F)F)ncc2n1C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KCNH2 Q12809 2/20 0.33
▸ GRM2 Q14416 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ DHODH Q02127 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
SCHEMBL19731192 0.92 LMNA (0.37) LMNARAB9ASMN1; SMN2KCNH2MEN1
SCHEMBL24286103 0.90 DDR1 (0.31) LMNAMEN1KMT2AALDH1A1
SCHEMBL17949561 0.88 L3MBTL1 (0.33) LMNAMEN1KMT2A
SCHEMBL24044957 0.87 BCHE (0.33) KCNH2
SCHEMBL24286744 0.87 MAP4K4 (0.36) LMNAMEN1KMT2AKDM4ECYP11B1
SCHEMBL31534715 0.86 DDR1 (0.31) ALDH1A1
SCHEMBL17967734 0.86 DDR1 (0.31) ALDH1A1
SCHEMBL17949566 0.85 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL17941403 0.85 MEN1 (0.33) LMNAGRM2MEN1KMT2ACYP11B1
SCHEMBL20468523 0.85 DGAT1 (0.31) ALDH1A1

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
US-20170362224-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-12-21 — — 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-20170362224-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, SQOR, PTMS SDHB 347/4885NPC1 3291/4885LMNA 4458/4885

“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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