SCHEMBL17301754

SCHEMBL17301754

CN1CC[C@@H](OC(=O)[C@H](O)c2ccccc2)C1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 6/20 0.66
HTT P42858 1/20 0.66
LMNA P02545 3/20 0.65
CYP2C9 P11712 1/20 0.65
HSD17B10 Q99714 1/20 0.65
CHRM1 P11229 5/20 0.64
CHRM3 P20309 4/20 0.64
CHRM4 P08173 3/20 0.64
CHRM5 P08912 3/20 0.64
CHRM2 P08172 3/20 0.64
BLM P54132 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
CYP1A2 P05177 3/20 0.51
NR1I2 O75469 1/20 0.51
ABCB11 O95342 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 3/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL19024036 1.00 CYP2D6 (0.66) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294717 1.00 CYP2D6 (0.66) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL19023859 1.00 CYP2D6 (0.66) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL29546035 1.00 CYP2D6 (0.66) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294715 1.00 CYP2D6 (0.66) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294643 0.92 CYP2D6 (0.79) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294709 0.92 CYP2D6 (0.79) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294712 0.92 CYP2D6 (0.79) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL17294707 0.92 CYP2D6 (0.79) CYP2D6HTTLMNACYP2C9HSD17B10
SCHEMBL29546616 0.92 CYP2D6 (0.79) CYP2D6HTTLMNACYP2C9HSD17B10

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 15 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-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed
EP-3148518-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed
US-10207993-B2 Compounds as anti-tubercular agents SPHAERA PHARMA PVT. LTD. (IN) 2019-02-19 US 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-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-11-23 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
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US disclosed
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US 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 CYP2D6 865/4885HTT 4686/4885LMNA 3630/4885
US-10207993-B2 Compounds as anti-tubercular agents FNTB, G6PD, PGGT1B CYP2D6 865/4885HTT 4686/4885LMNA 3630/4885
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CYP2D6 1722/4885HTT 4711/4885LMNA 3576/4885
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CYP2D6 1722/4885HTT 4711/4885LMNA 3576/4885

“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.