SCHEMBL17294698

SCHEMBL17294698

O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.57
CHRM1 P11229 3/20 0.57
CHRM3 P20309 3/20 0.57
CCR1 P32246 1/20 0.57
DRD2 P14416 3/20 0.52
DRD4 P21917 3/20 0.52
CCR2 P41597 2/20 0.52
ALDH1A1 P00352 1/20 0.51
NPC1 O15118 1/20 0.51
DRD3 P35462 1/20 0.50

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
SCHEMBL17294700 1.00 CHRM2 (0.57) CHRM2CHRM1CHRM3CCR1DRD2
SCHEMBL17301739 1.00 CHRM2 (0.57) CHRM2CHRM1CHRM3CCR1DRD2
SCHEMBL17294689 0.88 CHRM2 (0.55) CHRM2CHRM1CHRM3DRD2DRD4
SCHEMBL17294687 0.88 CHRM2 (0.55) CHRM2CHRM1CHRM3DRD2DRD4
SCHEMBL17294697 0.87 CHRM3 (0.55) CHRM2CHRM1CHRM3CCR1DRD2
SCHEMBL17294676 0.85 CHRM3 (0.72) CHRM2CHRM1CHRM3CCR1DRD2
SCHEMBL1623588 0.83 ALDH1A1 (0.60) DRD2DRD4CCR2ALDH1A1NPC1
SCHEMBL5143427 0.83 ALDH1A1 (0.60) DRD2DRD4CCR2ALDH1A1NPC1
SCHEMBL11949312 0.81 DRD2 (0.57) DRD2DRD4CCR2ALDH1A1NPC1
SCHEMBL16007156 0.81 DRD2 (0.57) DRD2DRD4CCR2ALDH1A1NPC1

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 CHRM2 2407/4885CHRM1 2034/4885CHRM3 2760/4885
US-10207993-B2 Compounds as anti-tubercular agents FNTB, G6PD, PGGT1B CHRM2 2407/4885CHRM1 2034/4885CHRM3 2760/4885
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CHRM2 2458/4885CHRM1 2219/4885CHRM3 2635/4885
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 CHRM2 2458/4885CHRM1 2219/4885CHRM3 2635/4885

“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.