SCHEMBL587938

SCHEMBL587938

COC(=O)C1=C(O)CCc2cc(Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 3/20 0.48
SRD5A2 P31213 2/20 0.48
ABL1 P00519 1/20 0.45
HTT P42858 1/20 0.43
SLC6A3 Q01959 6/20 0.42
SLC6A15 Q9H2J7 2/20 0.41
HSD17B3 P37058 2/20 0.40
ALPL P05186 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
SLC6A2 P23975 1/20 0.38

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
SCHEMBL588072 0.82 MAPK14 (0.43) SRD5A1SLC6A3ALPLKDM4EGLA
SCHEMBL588713 0.82 RAB9A (0.58) ALPLKDM4EGLAGAAMAPT
SCHEMBL4025662 0.81 SRD5A1 (0.61) SRD5A1SRD5A2HTTSLC6A15FNTA
SCHEMBL9448045 0.73 SRD5A1 (0.44) SRD5A1SRD5A2ABL1HTTSLC6A3
SCHEMBL6648373 0.73 L3MBTL1 (0.42) SRD5A1SRD5A2SLC6A3HSD17B3KDM4E
SCHEMBL12447830 0.73 SLC6A3 (0.44) SRD5A1SRD5A2ABL1SLC6A3HSD17B3
SCHEMBL23058960 0.72 MAPK14 (0.58) SRD5A1SRD5A2HSD17B3
SCHEMBL21474580 0.71 SLC6A3 (0.44) SRD5A1SRD5A2ABL1SLC6A3HSD17B3
SCHEMBL6100118 0.70 ABL1 (0.70) ABL1HTTSLC6A3ALPLKDM4E
SCHEMBL15282381 0.69 SRD5A1 (0.64) SRD5A1SRD5A2HTTSLC6A3SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258168-B2 2H or 3H-benzo[E]indazol-1-YL carbamate derivatives, the preparation and therapeutic use thereof SANOFI (FR) 2012-09-04 US disclosed
US-20120108584-A1 2H OR 3H-BENZO[E]INDAZOL-1-YL CARBAMATE DERIVATIVES, THE PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2012-05-03 US disclosed
US-8114899-B2 2H- or 3H-benzo[e]indazol-1-yl carbamate derivatives, the preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-02-14 US disclosed
US-20090143380-A1 2H- OR 3H-BENZO[E]INDAZOL-1-YL CARBAMATE DERIVATIVES, THE PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-06-04 US disclosed
US-7501449-B2 2H -or 3H-benzo[e]indazol-1-yl carbamate derivatives, the preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-03-10 US disclosed
US-20070105932-A1 2H-or 3H-benzo[e]indazol-1-yl carbamate derivatives, the preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-05-10 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 (3 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-20070105932-A1 2H-or 3H-benzo[e]indazol-1-yl carbamate derivatives, the preparation and therapeutic use thereof GLS2, GLS, CYP11B2 SRD5A1 1162/4885SRD5A2 925/4885ABL1 45/4885
US-20090143380-A1 2H- OR 3H-BENZO[E]INDAZOL-1-YL CARBAMATE DERIVATIVES, THE PREPARATION AND THERAPEUTIC USE THEREOF GLS2, GLS, SDHA SRD5A1 1025/4885SRD5A2 804/4885ABL1 65/4885
US-20120108584-A1 2H OR 3H-BENZO[E]INDAZOL-1-YL CARBAMATE DERIVATIVES, THE PREPARATION AND THERAPEUTIC USE THEREOF GLS2, GLS, SDHA SRD5A1 1244/4885SRD5A2 1008/4885ABL1 96/4885

“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.