SCHEMBL19600744

SCHEMBL19600744

CCCCOC(=O)c1ccc(N2CCN(C3CC(OCCCC)C3)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.46
P2RY12 Q9H244 1/20 0.45
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
OGA O60502 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.40
CYP1A2 P05177 2/20 0.40
TSHR P16473 2/20 0.40
CYP2C19 P33261 2/20 0.40
ME2 P23368 1/20 0.40
ME1 P48163 1/20 0.40
ME3 Q16798 1/20 0.40
ESR1 P03372 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPK1 P28482 1/20 0.40
NR1H2 P55055 1/20 0.40
RNASEL Q05823 1/20 0.40

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
SCHEMBL19600885 0.90 HRH3 (0.46) HRH3P2RY12KMT2AOGANPC1
SCHEMBL19600840 0.79 P2RY12 (0.48) HRH3P2RY12KMT2AMEN1OGA
SCHEMBL19600800 0.78 HRH3 (0.49) HRH3P2RY12KMT2AMEN1OGA
SCHEMBL19581023 0.78 KMT2A (0.50) HRH3P2RY12KMT2AMEN1NPC1
SCHEMBL19601063 0.77 HRH3 (0.48) HRH3P2RY12KMT2AMEN1OGA
SCHEMBL19600751 0.77 HRH3 (0.56) HRH3KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL19601033 0.77 HRH3 (0.56) HRH3KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9304217 0.77 HRH3 (0.48) HRH3P2RY12KMT2AMEN1OGA
SCHEMBL9303977 0.77 HRH3 (0.48) HRH3P2RY12KMT2AMEN1OGA
SCHEMBL19600720 0.76 HRH3 (0.48) HRH3P2RY12KMT2AMEN1OGA

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-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2017-11-16 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-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, MDM2, ESRRA HRH3 3784/4885P2RY12 4874/4885KMT2A 1478/4885

“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.