SCHEMBL17294692

SCHEMBL17294692

CN1CCC[C@@H](NC(=O)C(O)(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.58
CHRM3 P20309 6/20 0.54
CHRM2 P08172 5/20 0.54
CHRM1 P11229 5/20 0.54
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CHEK1 O14757 1/20 0.47
SSTR1 P30872 3/20 0.45
SSTR4 P31391 3/20 0.45
CHRNB2 P17787 2/20 0.44
CHRNB4 P30926 2/20 0.44
CHRNA3 P32297 2/20 0.44
CHRNA4 P43681 2/20 0.44

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
SCHEMBL17294683 1.00 CCR1 (0.58) CCR1CHRM3CHRM2CHRM1ATM
SCHEMBL17294626 1.00 CCR1 (0.58) CCR1CHRM3CHRM2CHRM1ATM
SCHEMBL17294700 0.80 CHRM2 (0.57) CCR1CHRM3CHRM2CHRM1
SCHEMBL17301739 0.80 CHRM2 (0.57) CCR1CHRM3CHRM2CHRM1
SCHEMBL17294698 0.80 CHRM2 (0.57) CCR1CHRM3CHRM2CHRM1
SCHEMBL4356360 0.78 CTSL (0.57) CHRM1CHEK1CHRNB2CHRNB4CHRNA3
SCHEMBL10210847 0.78 CTSL (0.57) CHRM1CHEK1CHRNB2CHRNB4CHRNA3
SCHEMBL24672004 0.76 CCR1 (0.44) CCR1CHRM3CHRM2CHRM1ATM
SCHEMBL10211615 0.76 EPHX2 (0.64)
SCHEMBL10210791 0.76 EPHX1 (0.64) ATMCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10207993-B2 Compounds as anti-tubercular agents SPHAERA PHARMA PVT. LTD. (IN) 2019-02-19 US claimed
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-11-23 US claimed
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US claimed
EP-3148518-A2 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS Sphaera Pharma Pvt. Ltd. (IN) 2017-04-05 EP claimed
WO-2015181837-A2 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2015-12-03 WO claimed
EP-3148518-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed
CN-106659697-B Compounds as antituberculosis agents 斯菲叶尔制药私有公司 2022-03-29 CN disclosed
US-10207993-B2 Compounds as anti-tubercular agents SPHAERA PHARMA PVT. LTD. (IN) 2019-02-19 US disclosed
US-10100012-B2 Compounds as anti-tubercular agents SPHAERA PHARMA PVT. LTD. (IN) 2018-10-16 US disclosed
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-11-23 US disclosed
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US disclosed
EP-3148518-A2 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS Sphaera Pharma Pvt. Ltd. (IN) 2017-04-05 EP disclosed
WO-2015181837-A2 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2015-12-03 WO 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 (4 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-10100012-B2 Compounds as anti-tubercular agents FNTB, G6PD, PGGT1B CCR1 1514/4885CHRM3 2760/4885CHRM2 2407/4885
US-10207993-B2 Compounds as anti-tubercular agents FNTB, G6PD, PGGT1B CCR1 1514/4885CHRM3 2760/4885CHRM2 2407/4885
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CCR1 1727/4885CHRM3 2635/4885CHRM2 2458/4885
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CCR1 1727/4885CHRM3 2635/4885CHRM2 2458/4885

“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.