SCHEMBL20043149

SCHEMBL20043149

CCSc1c(-c2nc3cc(C(F)(F)F)nnc3n2C)sc(-c2ccc(Cl)cc2)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ CCNC P24863 1/20 0.31
▸ CDK8 P49336 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ ADORA2A P29274 1/20 0.30
▸ PDE2A O00408 2/20 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
SCHEMBL18173822 0.84 LMNA (0.34) LMNAKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL18173870 0.83 LMNA (0.34) LMNAKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL23748081 0.79 PTGS2 (0.36) LMNAKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL18179727 0.75 PTGS2 (0.36) LMNAKDM4EALDH1A1PTGS1PTGS2
SCHEMBL20047395 0.75 POLB (0.30) POLB
SCHEMBL18173814 0.73 — —
SCHEMBL24183784 0.73 KDM4E (0.33) LMNAKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL18498642 0.71 CYP11B1 (0.35) LMNAALDH1A1L3MBTL1NPSR1
SCHEMBL20043148 0.71 TSHR (0.30) —
SCHEMBL17696192 0.71 POLB (0.33) LMNAKDM4EALDH1A1HPGDPOLB

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-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2018-04-12 — — US disclosed
US-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2018-04-12 — — 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-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES DDT, NIT2, SQOR LMNA 4408/4885KDM4E 2923/4885ALDH1A1 1590/4885

“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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