SCHEMBL13710247

SCHEMBL13710247

Cc1sc(-c2ccc(Cl)cc2)nc1C1=C(OC(=O)N2CCOCC2)CC(C)(C)CC1O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 9/20 0.45
▸ KDM4E B2RXH2 2/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ MAPK1 P28482 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL13761083 0.79 HRH3 (0.43) HRH3KDM4ECNR1MAPK1TSHR
SCHEMBL13712411 0.79 APEX1 (0.37) HRH3KDM4EMAPTPOLBNPC1
SCHEMBL13710231 0.73 HRH3 (0.46) HRH3KDM4ECNR1MAPK1TSHR
SCHEMBL13710244 0.70 LMNA (0.46) HRH3KDM4ELMNAMAPTPOLB
SCHEMBL14064299 0.68 SLC2A1 (0.41) HRH3KDM4ETSHRLMNAMAPT
SCHEMBL13710228 0.65 RARA (0.46) KDM4ELMNAMAPTPOLBNPC1
SCHEMBL13761086 0.65 MAPT (0.44) HRH3LMNAMAPTPOLB
SCHEMBL14064298 0.64 APEX1 (0.40) HRH3KDM4ECNR1MAPK1LMNA
SCHEMBL5649433 0.63 SMN1; SMN2 (0.53) KDM4EMAPK1TSHRLMNAMAPT
SCHEMBL13710241 0.63 KMT2A (0.42) HRH3KDM4ELMNAMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595404-B2 Thiazolyl-substituted carbocyclic 1,3-diones as pesticidal agents BAYER CROPSCIENCE AG (DE) 2009-09-29 — — US disclosed
US-7595404-B2 Thiazolyl-substituted carbocyclic 1,3-diones as pesticidal agents BAYER CROPSCIENCE AG (DE) 2009-09-29 — — US disclosed
US-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-06-14 — — US disclosed
US-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-06-14 — — 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-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents DDT, CYP4B1, CYP1B1 HRH3 2958/4885KDM4E 1623/4885CNR1 1371/4885

“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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