SCHEMBL18160239

SCHEMBL18160239

Cc1ccc(F)c(C(=O)Nc2ccc(F)cc2F)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.58
TAS1R1 Q7RTX1 1/20 0.58
TAS1R2 Q8TE23 1/20 0.58
LMNA P02545 2/20 0.57
MAPT P10636 3/20 0.56
POLB P06746 1/20 0.56
PKM P14618 1/20 0.56
HTT P42858 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL18160310 0.87 TAS1R3 (0.58) TAS1R3TAS1R1TAS1R2LMNAMAPT
SCHEMBL18160318 0.82 GPR6 (0.47) LMNAPKMSMN1; SMN2ALDH1A1
SCHEMBL18146314 0.82 TAS1R3 (0.58) TAS1R3TAS1R1TAS1R2MAPTPOLB
SCHEMBL18160397 0.81 LMNA (0.61) LMNAHTTNPC1RAB9ASMN1; SMN2
SCHEMBL19392337 0.81 NPC1 (0.71) LMNAMAPTPOLBPKMHTT
SCHEMBL14363404 0.81 TAS1R3 (0.60) TAS1R3TAS1R1TAS1R2LMNAMAPT
SCHEMBL30599567 0.80 MAPT (0.71) TAS1R3TAS1R1TAS1R2LMNAMAPT
SCHEMBL23242505 0.79 KCNMA1 (0.52) TAS1R3TAS1R1TAS1R2LMNAMAPT
SCHEMBL9364603 0.79 TAS1R3 (0.56) TAS1R3TAS1R1TAS1R2LMNAMAPT
SCHEMBL29800683 0.79 KCNMA1 (0.52) TAS1R3TAS1R1TAS1R2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-11-30 US disclosed
US-9781935-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-10 US disclosed
US-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2016-10-20 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 (2 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-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD TAS1R3 2093/4885TAS1R1 2404/4885TAS1R2 2583/4885
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD TAS1R3 2093/4885TAS1R1 2404/4885TAS1R2 2583/4885

“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.