SCHEMBL19699773

SCHEMBL19699773

Cc1ccc(C(=O)O)c(N2CC3(COC3)C2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RBP4 P02753 1/20 0.42
▸ CHRM4 P08173 2/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ KIF18A Q8NI77 3/20 0.37
▸ KCNQ3 O43525 1/20 0.36
▸ KCNQ2 O43526 1/20 0.36
▸ PDE10A Q9Y233 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ ACLY P53396 1/20 0.34
▸ SYK P43405 1/20 0.33
▸ PFKFB3 Q16875 1/20 0.33
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GABRA2 P47869 1/20 0.33

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
SCHEMBL20599223 0.86 RBP4 (0.41) RBP4PKM
SCHEMBL19699774 0.80 CHRM4 (0.42) CHRM4KIF18AKCNQ3KCNQ2SYK
SCHEMBL18395148 0.78 PKM (0.47) RBP4KMT2AMEN1PKM
SCHEMBL12983811 0.78 GABRP (0.43) HDAC4KIF18AKCNQ3KCNQ2PDE10A
SCHEMBL25389483 0.77 RBP4 (0.44) RBP4KIF18AKMT2A
SCHEMBL19699772 0.76 KMT2A (0.53) RBP4HDAC4PDE10AKMT2AMEN1
SCHEMBL20619561 0.76 VNN1 (0.39) —
SCHEMBL6646384 0.75 SCN10A (0.51) RBP4KMT2AMEN1
SCHEMBL23779540 0.75 SCN10A (0.51) RBP4KMT2AMEN1
SCHEMBL19699776 0.74 DHODH (0.39) CHRM4HDAC4SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355717-A1 NOVEL 5,6-DIHYDRO-4H-BENZO[B]THIENO-[2,3-D]AZEPINE DERIVATIVES PULMOCIDE LIMITED (GB) 2017-12-14 — — 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-20170355717-A1 NOVEL 5,6-DIHYDRO-4H-BENZO[B]THIENO-[2,3-D]AZEPINE DERIVATIVES ZC3HAV1, DHX15, AZI2 RBP4 471/4885CHRM4 2661/4885HDAC4 944/4885

“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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