SCHEMBL6484237

SCHEMBL6484237

COc1ccccc1[C@H]1CO1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.50
HTR2A P28223 1/20 0.50
HTR2B P41595 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CYP19A1 P11511 2/20 0.47
DRD2 P14416 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
USP2 O75604 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ADRA1A P35348 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL935859 1.00 HTR2C (0.50) HTR2CHTR2AHTR2BCA12CA1
SCHEMBL29474981 1.00 HTR2C (0.50) HTR2CHTR2AHTR2BCA12CA1
SCHEMBL29041073 0.84 HTR2C (0.51) HTR2CHTR2AHTR2BCA12CA1
SCHEMBL27845790 0.83 TSHR (0.44) HTR2CHTR2AHTR2BCYP19A1DRD2
SCHEMBL7786361 0.82 CYP19A1 (0.49) CYP19A1ADRA1ATSHR
SCHEMBL4753995 0.80 ALDH1A1 (0.41) HTR2CHTR2AHTR2BDRD2ADRA1A
SCHEMBL30949067 0.80 HTR2C (0.47) HTR2CHTR2AHTR2BDRD2MEN1
SCHEMBL11302784 0.79 HTR2B (0.55) HTR2CHTR2AHTR2BMEN1KMT2A
SCHEMBL14945596 0.79 HDAC4 (0.42) HTR2CHTR2AHTR2BMEN1KMT2A
SCHEMBL22994705 0.78 ALDH1A1 (0.44) HTR2CHTR2AHTR2BADRA1ATSHR

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-8217184-B2 Process for producing optically active cis-silyl olefin oxide compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-07-10 US disclosed
US-8217184-B2 Process for producing optically active cis-silyl olefin oxide compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-07-10 US disclosed
US-20100305338-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE CIS-SILYL OLEFIN OXIDE COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-02 US disclosed
US-20100305338-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE CIS-SILYL OLEFIN OXIDE COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-02 US disclosed
WO-2005003140-A1 4-OXO-4,7-DIHYDROTHIENO[2,3-B]PYRIDINE-5-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-01-13 WO disclosed
US-20050004161-A1 4-oxo-4,7-dihydrothieno[2,3-b]pyridine-5-carboxamides as antiviral agents AGOURON PHARMACEUTICALS, INC. 2005-01-06 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 (2 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-20100305338-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE CIS-SILYL OLEFIN OXIDE COMPOUND CYP51A1, MSMO1, SQLE HTR2C 4212/4885HTR2A 4580/4885HTR2B 3747/4885
US-20050004161-A1 4-oxo-4,7-dihydrothieno[2,3-b]pyridine-5-carboxamides as antiviral agents ZC3HAV1, IRF3, BRD4 HTR2C 2272/4885HTR2A 3568/4885HTR2B 1046/4885

“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.