SCHEMBL19658489

SCHEMBL19658489

CCCc1cc(N2CCC(N(C)C(C)=O)CC2)ncn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.43
LOXL2 Q9Y4K0 4/20 0.42
HRH4 Q9H3N8 2/20 0.42
JAK2 O60674 1/20 0.40
PKM P14618 1/20 0.40
OPRD1 P41143 1/20 0.39
TAF1 P21675 6/20 0.39
CECR2 Q9BXF3 6/20 0.39
BRD9 Q9H8M2 6/20 0.39
IKBKB O14920 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
AOC3 Q16853 1/20 0.38
NPY5R Q15761 1/20 0.36
ACACB O00763 1/20 0.35

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
SCHEMBL19652217 0.87 HRH4 (0.40) LOXL2HRH4JAK2PKMTAF1
SCHEMBL19658407 0.78 CYP2C19 (0.52) MAP4K4HRH4OPRD1TAF1CECR2
SCHEMBL19658497 0.78 MAP4K4 (0.45) MAP4K4HRH4OPRD1TAF1CECR2
SCHEMBL19658786 0.78 TAF1 (0.51) MAP4K4HRH4JAK2OPRD1TAF1
SCHEMBL19658510 0.74 OPRD1 (0.47) MAP4K4HRH4JAK2OPRD1TAF1
SCHEMBL19658782 0.74 TAF1 (0.54) MAP4K4JAK2OPRD1TAF1CECR2
SCHEMBL19658736 0.74 GPR119 (0.52) MAP4K4OPRD1TAF1CECR2BRD9
SCHEMBL19658507 0.72 CYP1A2 (0.60) MAP4K4LOXL2HRH4OPRD1TAF1
SCHEMBL19658512 0.72 TAF1 (0.56) MAP4K4OPRD1TAF1CECR2BRD9
SCHEMBL19658509 0.71 TAF1 (0.45) MAP4K4JAK2OPRD1TAF1CECR2

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-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 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-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 MAP4K4 1182/4885LOXL2 4297/4885HRH4 241/4885

“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.