SCHEMBL9946032

SCHEMBL9946032

Cc1ccc(COc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.64
RXRB P28702 1/20 0.64
MAOB P27338 2/20 0.56
PARP10 Q53GL7 1/20 0.54
FFAR1 O14842 2/20 0.54
IDO1 P14902 2/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
CASP3 P42574 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
HRH3 Q9Y5N1 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 2/20 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
SCHEMBL9946062 1.00 RXRA (0.64) RXRARXRBMAOBPARP10FFAR1
SCHEMBL12279053 0.92 RXRA (0.72) RXRARXRBMAOBIDO1NPC1
SCHEMBL13160063 0.92 RXRA (0.72) RXRARXRBMAOBIDO1NPC1
SCHEMBL10022960 0.89 MAOB (0.56) RXRARXRBMAOBPARP10FFAR1
SCHEMBL762195 0.86 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL8929713 0.86 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL891195 0.86 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL8930213 0.86 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL24507788 0.85 RXRA (0.69) RXRARXRBMAOBIDO1NPC1
SCHEMBL15132940 0.85 RXRA (0.64) RXRARXRBMAOBFFAR1IDO1

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-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 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-20120149693-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 RXRA 1479/4885RXRB 921/4885MAOB 780/4885

“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.