SCHEMBL5658990

SCHEMBL5658990

CCc1cc(C2(c3ccc(O)c(CC)c3)C(=O)N(Cc3ccccc3)c3ccccc32)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.54
GPR55 Q9Y2T6 1/20 0.54
SCN9A Q15858 8/20 0.50
ALDH1A1 P00352 7/20 0.48
NPSR1 Q6W5P4 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
HSD17B10 Q99714 1/20 0.44
P2RX1 P51575 1/20 0.44
P2RX3 P56373 1/20 0.44
P2RX4 Q99571 1/20 0.44
P2RX7 Q99572 1/20 0.44
TP53 P04637 2/20 0.43
MAPT P10636 1/20 0.43
USP2 O75604 1/20 0.42

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
SCHEMBL5658501 0.87 CNR1 (0.52) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL5658318 0.78 SCN9A (0.52) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL5659203 0.78 CNR1 (0.52) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL5660616 0.77 CNR1 (0.61) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL5658420 0.76 MAPT (0.49) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL25907883 0.73 CNR1 (0.54) CNR1GPR55SCN9ANPSR1SMN1; SMN2
SCHEMBL25118979 0.72 CNR1 (0.53) CNR1GPR55SCN9ANPSR1SMN1; SMN2
SCHEMBL14457581 0.71 SCN9A (0.51) CNR1GPR55SCN9AALDH1A1SMN1; SMN2
SCHEMBL14457619 0.71 CNR1 (0.47) CNR1GPR55SCN9AALDH1A1NPSR1
SCHEMBL29587240 0.71 ESR1 (0.64) CNR1GPR55NPSR1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250442-B2 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2005-03-10 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-20050054712-A1 Dihydroindol-2-one derivatives as steroid hormone nuclear receptor modulators NR3C2, NR5A1, NR5A2 CNR1 362/4885GPR55 77/4885SCN9A 1918/4885

“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.