SCHEMBL18965273

SCHEMBL18965273

CC(C)N1CCC(c2ccc(C(F)(F)F)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 5/20 0.47
▸ NR3C1 P04150 2/20 0.40
▸ GPR119 Q8TDV5 1/20 0.39
▸ OGA O60502 3/20 0.39
▸ SMO Q99835 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SCN9A Q15858 1/20 0.38
▸ PSEN1 P49768 1/20 0.38
▸ PSEN2 P49810 1/20 0.38
▸ APH1B Q8WW43 1/20 0.38
▸ NCSTN Q92542 1/20 0.38
▸ APH1A Q96BI3 1/20 0.38
▸ PSENEN Q9NZ42 1/20 0.38
▸ SLC6A9 P48067 1/20 0.37

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
SCHEMBL21037760 0.84 KCNH2 (0.47) GPR119SMOKDM4EABL1LMNA
SCHEMBL29852305 0.81 KMT2A (0.42) GPR119KDM4EABL1LMNA
SCHEMBL16452781 0.81 KMT2A (0.42) GPR119KDM4EABL1LMNA
SCHEMBL21038286 0.81 HRH3 (0.45) HRH3
SCHEMBL21037497 0.79 HRH3 (0.48) HRH3OGA
SCHEMBL16452775 0.78 PPARD (0.40) GPR119KDM4EABL1LMNA
SCHEMBL28131310 0.78 ALOX5AP (0.43) GPR119KDM4EABL1LMNA
SCHEMBL20147461 0.78 LIPE (0.57) HRH3SCN9A
SCHEMBL23483118 0.78 HRH3 (0.40) HRH3
SCHEMBL171140 0.78 HRH3 (0.36) HRH3

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-20190161499-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-05-30 — — US disclosed
WO-2017097927-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-15 — — 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-20190161499-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES ACHE, AADAC, ATL3 HRH3 1945/4885NR3C1 4709/4885GPR119 2479/4885

“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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