SCHEMBL20635344

SCHEMBL20635344

CCSc1cccnc1-c1nc2cc(SC(F)F)ncc2n1C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31

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
SCHEMBL20610183 0.82 NPC1 (0.35) KDM4ELMNANPC1RAB9A
SCHEMBL20610237 0.82 KDM4E (0.33) KDM4ELMNACYP11B1CYP11B2NPC1
SCHEMBL24286105 0.81 PTGS2 (0.34) KDM4ELMNACYP11B1CYP11B2NPC1
SCHEMBL20635343 0.81 NPC1 (0.31) NPC1RAB9A
SCHEMBL15275085 0.78 NLRP3 (0.40) KDM4ELMNANPC1RAB9A
SCHEMBL29431645 0.76 NPC1 (0.38) KDM4ELMNANPC1RAB9A
SCHEMBL18401200 0.76 NPC1 (0.38) KDM4ELMNANPC1RAB9A
SCHEMBL14677112 0.76 NPC1 (0.38) KDM4ELMNANPC1RAB9A
SCHEMBL14677508 0.76 HTR2B (0.39) KDM4ENPC1RAB9A
SCHEMBL29431648 0.76 NPC1 (0.36) KDM4ELMNACYP11B1CYP11B2NPC1

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-20200131177-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-04-30 — — US disclosed
WO-2019008115-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-01-10 — — 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-20200131177-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, ACHE, SQOR KDM4E 3548/4885LMNA 4514/4885CYP11B1 49/4885

“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.

Send feedback