SCHEMBL6685154

SCHEMBL6685154

CCS(=O)(=O)n1c(C(=O)O)cc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.57
CCR2 P41597 5/20 0.56
DAO P14920 1/20 0.54
ALDH1A1 P00352 3/20 0.51
TSHR P16473 1/20 0.51
BCL2 P10415 1/20 0.49
BID P55957 1/20 0.49
NOD2 Q9HC29 4/20 0.49
NOD1 Q9Y239 4/20 0.49
CYP1A2 P05177 1/20 0.49
POLB P06746 1/20 0.49
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7743563 0.84 MCL1 (0.60) MCL1CCR2DAOALDH1A1TSHR
SCHEMBL20969368 0.84 NOD2 (0.55) MCL1CCR2ALDH1A1NOD2NOD1
SCHEMBL26967654 0.80 MCL1 (0.55) MCL1CCR2DAOALDH1A1TSHR
SCHEMBL4121234 0.79 CCR2 (0.72) MCL1CCR2DAOALDH1A1TSHR
SCHEMBL31599460 0.79 CCR2 (0.72) MCL1CCR2DAOALDH1A1TSHR
Hydrochloric Acid SCHEMBL4119324 0.78 CCR2 (0.71) MCL1CCR2DAOALDH1A1TSHR
SCHEMBL16794402 0.77 NOD1 (0.71) MCL1CCR2DAOALDH1A1BCL2
SCHEMBL13114468 0.76 CCR2 (0.64) MCL1CCR2DAOALDH1A1BCL2
SCHEMBL30067600 0.76 CCR2 (0.69) MCL1CCR2DAOALDH1A1TSHR
SCHEMBL701976 0.76 CCR2 (0.69) MCL1CCR2DAOALDH1A1TSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3483162-B1 N-ALKYLSULFONYL CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, PESTICIDE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAID PESTICIDE NIHON NOHYAKU CO LTD (JP) 2021-10-06 EP disclosed
CN-109415370-B N-alkylsulfonyl fused heterocyclic compound or salt thereof, insecticide containing the compound, and method of using the same 日本农药株式会社 2021-06-08 CN disclosed
US-20190174760-A1 N-ALKYLSULFONYL CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2019-06-13 US disclosed
EP-3483162-A1 N-ALKYLSULFONYL-FUSED HETEROCYCLIC COMPOUND OR SALT THEREOF, PESTICIDE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAID PESTICIDE Nihon Nohyaku Co., Ltd. (JP) 2019-05-15 EP disclosed
CN-109415370-A N-alkylsulfonyl fused heterocyclic compound or salt thereof, insecticide containing the compound, and method of using the same 日本农药株式会社 2019-03-01 CN disclosed
EP-1018878-B1 NOVEL INDOLECARBOXAMIDES, PHARMACEUTICAL COMPOSITIONS AND METHODSOF INHIBITING CALPAIN SMITHKLINE BEECHAM CORP (US) 2004-10-06 EP 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-20190174760-A1 N-ALKYLSULFONYL CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, INSECTICIDE COMPRISING THE COMPOUND, AND METHOD FOR USING THE INSECTICIDE C1S, HCN1, H1-0 MCL1 2813/4885CCR2 1138/4885DAO 2930/4885

“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.