SCHEMBL19658784

SCHEMBL19658784

CC(=O)N(C)C1CCN(c2cc(C3CC3)nc(C)n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAF1 P21675 4/20 0.51
CECR2 Q9BXF3 4/20 0.51
BRD9 Q9H8M2 4/20 0.51
MAP4K4 O95819 1/20 0.40
HRH4 Q9H3N8 4/20 0.38
CXCR4 P61073 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
RAD52 P43351 1/20 0.37
CASP7 P55210 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
OPRD1 P41143 1/20 0.35
SYK P43405 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 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
SCHEMBL19652226 0.87 TAF1 (0.51) TAF1CECR2BRD9HRH4CXCR4
SCHEMBL19658409 0.86 TAF1 (0.48) TAF1CECR2BRD9MAP4K4KDM4E
SCHEMBL19658491 0.80 CHRM3 (0.43) TAF1CECR2BRD9MAP4K4KDM4E
SCHEMBL19652211 0.72 TAF1 (0.47) TAF1CECR2BRD9KDM4EALDH1A1
SCHEMBL19658594 0.69 KDM4E (0.58) KDM4EALDH1A1GAAGPR119
SCHEMBL28805790 0.68 GBA1 (0.52) TAF1CECR2BRD9HRH4KDM4E
SCHEMBL19658591 0.68 GPR119 (0.44) MAP4K4KDM4EHPGDHSD17B10GPR119
SCHEMBL19658736 0.68 GPR119 (0.52) TAF1CECR2BRD9MAP4K4GPR119
SCHEMBL19658466 0.68 RIPK1 (0.46) MAP4K4OPRD1
SCHEMBL19652228 0.68 CHRM3 (0.41) TAF1CECR2BRD9KDM4EALDH1A1

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 TAF1 439/4885CECR2 184/4885BRD9 16/4885

“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.