SCHEMBL768785

SCHEMBL768785

CN1C(=O)Cc2c1ccc(-c1cncc(S(=O)(=O)N(C)C)c1)c2Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
TSPO P30536 1/20 0.36
BMPR1A P36894 12/20 0.36
ACVRL1 P37023 12/20 0.36
ACVR1 Q04771 12/20 0.36
BMPR1B O00238 11/20 0.36
PKM P14618 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
CACNA1F O60840 1/20 0.35
ALB P02768 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL769387 0.82 LMNA (0.41) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL769240 0.81 CYP11B1 (0.41) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL750894 0.80 BMPR1A (0.40) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL769004 0.80 CYP11B2 (0.44) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL749146 0.80 BMPR1A (0.40) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL777743 0.79 CYP11B2 (0.46) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL769107 0.78 ACVRL1 (0.60) BMPR1AACVRL1ACVR1BMPR1BTGFBR1
SCHEMBL769027 0.78 CYP11B2 (0.41) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL768345 0.77 MEN1 (0.40) LMNAGAATSPOBMPR1AACVRL1
SCHEMBL769604 0.77 CYP11B1 (0.40) LMNAGAATSPOBMPR1AACVRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140275175-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-09-18 US disclosed
US-20140275175-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-09-18 US disclosed
US-8778972-B2 5-pyridin-3-yl-1, 3-dihydro-indol-2-on derivatives and their use as modulators of aldosterone synthase and/or CYP11B1 NOVARTIS AG (CH) 2014-07-15 US disclosed
US-8778972-B2 5-pyridin-3-yl-1, 3-dihydro-indol-2-on derivatives and their use as modulators of aldosterone synthase and/or CYP11B1 NOVARTIS AG (CH) 2014-07-15 US disclosed
US-8778972-B2 5-pyridin-3-yl-1, 3-dihydro-indol-2-on derivatives and their use as modulators of aldosterone synthase and/or CYP11B1 NOVARTIS AG (CH) 2014-07-15 US disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 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-20140275175-A1 ORGANIC COMPOUNDS CYP11B2, CYP11B1, SLCO1B1 PIK3C3 1201/4885LMNA 4017/4885GAA 239/4885
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 CYP11B1, HSD11B1, CYP11B2 PIK3C3 3188/4885LMNA 1338/4885GAA 3650/4885

“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.