SCHEMBL326892

SCHEMBL326892

COc1ccc2c(c1)C(O)CC2

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.54
CYP19A1 P11511 3/20 0.52
CYP11B1 P15538 1/20 0.52
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
MTNR1B P49286 7/20 0.51
NQO2 P16083 6/20 0.51
SIGMAR1 Q99720 2/20 0.50
DRD2 P14416 1/20 0.50
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
SCHEMBL6805525 0.90 MTNR1B (0.51) MTNR1AHTR2AHTR2CHTR2BMTNR1B
SCHEMBL1478135 0.90 MTNR1B (0.51) MTNR1AHTR2AHTR2CHTR2BMTNR1B
SCHEMBL6797543 0.90 MTNR1B (0.51) MTNR1AHTR2AHTR2CHTR2BMTNR1B
SCHEMBL15540347 0.86 MTNR1A (0.43) MTNR1ACYP19A1CYP11B1HTR2AHTR2C
SCHEMBL607389 0.86 CYP19A1 (0.52) CYP19A1HTR2CDRD2DRD3
SCHEMBL22477091 0.81 HTR2A (0.51) MTNR1ACYP19A1CYP11B1HTR2AHTR2C
SCHEMBL4132717 0.80 MTNR1A (0.49) MTNR1ACYP19A1CYP11B1HTR2AHTR2C
SCHEMBL30715531 0.80 MTNR1A (0.49) MTNR1ACYP19A1CYP11B1HTR2AHTR2C
SCHEMBL30715541 0.80 MTNR1A (0.49) MTNR1ACYP19A1CYP11B1HTR2AHTR2C
SCHEMBL13363972 0.80 DRD2 (0.53) MTNR1ACYP19A1CYP11B1HTR2AHTR2C

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12636266-B2 Indane-, indene-, azaindane-, and azaindene-amines as activators of serotonin receptors Rivo Bio, Inc. (US) 2026-05-26 US disclosed
US-20250228798-A1 INDANE-, INDENE-, AZAINDANE-, AND AZAINDENE-AMINES AS ACTIVATORS OF SEROTONIN RECEPTORS Rivo Bio, Inc. 2025-07-17 US disclosed
US-11427598-B2 Spiro-cyclic amine derivatives as S1P modulators AbbVie Deutschland GmbH & Co. KG (DE) 2022-08-30 US disclosed
US-20210130364-A1 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS ABBVIE B.V. (NL) 2021-05-06 US disclosed
US-10807991-B2 Spiro-cyclic amine derivatives as S1P modulators ABBVIE B.V. (NL) 2020-10-20 US disclosed
US-20190218227-A1 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS AbbVie Deutschland GmbH & Co. KG (DE) 2019-07-18 US disclosed
US-10179791-B2 Spiro-cyclic amine derivatives as S1P modulators ABBVIE B.V. (NL) 2019-01-15 US disclosed
US-9951084-B2 Spiro-cyclic amine derivatives as S1P modulators Abb Vie B.V. (NL) 2018-04-24 US disclosed
EP-3144312-A1 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS AbbVie B.V. (NL) 2017-03-22 EP disclosed
EP-2590955-B9 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS ABBVIE BV (NL) 2017-02-22 EP disclosed
US-20070066647-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders AMGEN ING. (US) 2007-03-22 US disclosed
US-7071201-B2 Serotonin antagonism; muscle relaxant for myotonia; such as 1-(1-(2-(4-methoxyphenyl)ethyl)piperidin-4-yl)-7-methoxy-1,2,3,4 -tetrahydroquinoline EISAI CO., LTD. (JP) 2006-07-04 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 EP disclosed
US-6579881-B2 Indoles EISAI CO., LTD. (JP) 2003-06-17 US disclosed
US-6448243-B1 SEROTONIN ANTAGONIST FOR TREATING, AMELIORATING AND PREVENTING SPASTIC PARALYSIS OR CENTRAL MUSCLE RELAXANTS FOR AMELIORATING MYOTONIA EISAI CO., LTD. (JP) 2002-09-10 US disclosed
WO-2002059081-A2 UREA DERIVATIVES AS INHIBITORS OF CCR-3 RECEPTOR KIRIN BEER KABUSHIKI KAISHA (JP) 2002-08-01 WO disclosed
US-20020086999-A1 Certain quinoline derivatives EISAI CO., LTD. 2002-07-04 US disclosed
US-20020019531-A1 Indoles EISAI CO., LTD. 2002-02-14 US disclosed
EP-0976732-A1 1,4-SUBSTITUTED CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 2000-02-02 EP disclosed
US-4963680-A INTERMEDIATES FOR THERAPEUTIC DRUGS SYNTHELABO (FR) 1990-10-16 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 (10 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-11427598-B2 Spiro-cyclic amine derivatives as S1P modulators S1PR1, S1PR3, S1PR2 MTNR1A 194/4885CYP19A1 2329/4885CYP11B1 504/4885
US-20020019531-A1 Indoles INMT, MUSK, MB MTNR1A 6/4885CYP19A1 3511/4885CYP11B1 368/4885
US-20190218227-A1 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS S1PR1, S1PR3, S1PR2 MTNR1A 176/4885CYP19A1 2152/4885CYP11B1 448/4885
US-10807991-B2 Spiro-cyclic amine derivatives as S1P modulators S1PR1, S1PR3, S1PR2 MTNR1A 194/4885CYP19A1 2329/4885CYP11B1 504/4885
US-20070066647-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders PC, PNLIP, PDHX MTNR1A 189/4885CYP19A1 514/4885CYP11B1 145/4885
US-20250228798-A1 INDANE-, INDENE-, AZAINDANE-, AND AZAINDENE-AMINES AS ACTIVATORS OF SEROTONIN RECEPTORS HTR2A, HTR1A, HTR2C MTNR1A 92/4885CYP19A1 585/4885CYP11B1 1761/4885
US-12636266-B2 Indane-, indene-, azaindane-, and azaindene-amines as activators of serotonin receptors CNR1, HTR1A, HTR1B MTNR1A 35/4885CYP19A1 675/4885CYP11B1 389/4885
US-20020086999-A1 Certain quinoline derivatives CHRM1, CHRNA5, CHRNA4 MTNR1A 12/4885CYP19A1 2761/4885CYP11B1 581/4885
US-10179791-B2 Spiro-cyclic amine derivatives as S1P modulators S1PR3, S1PR1, S1PR2 MTNR1A 958/4885CYP19A1 1552/4885CYP11B1 189/4885
US-20210130364-A1 SPIRO-CYCLIC AMINE DERIVATIVES AS S1P MODULATORS S1PR1, S1PR3, S1PR2 MTNR1A 194/4885CYP19A1 2329/4885CYP11B1 504/4885

“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.