SCHEMBL1154652

SCHEMBL1154652

OC1CCc2ccc(Cl)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.47
HTR2C P28335 7/20 0.46
HTR2B P41595 7/20 0.46
HTR2A P28223 6/20 0.46
SLC6A4 P31645 2/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
CNR1 P21554 1/20 0.46
SLC6A2 P23975 1/20 0.46
HRH1 P35367 1/20 0.46
KCNH2 Q12809 1/20 0.46
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PYGL P06737 1/20 0.41
CHRM4 P08173 2/20 0.40
HTR7 P34969 2/20 0.40

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
SCHEMBL1154693 1.00 MAP3K14 (0.47) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL1155475 1.00 MAP3K14 (0.47) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL6026462 0.89 MAP3K14 (0.45) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL1693312 0.84 MAP3K14 (0.51) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL29959450 0.84 MAP3K14 (0.51) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL9281232 0.84 MAP3K14 (0.51) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL15909359 0.84 MAP3K14 (0.51) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL19899043 0.81 HTR2C (0.44) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL19899047 0.81 HTR2C (0.44) MAP3K14HTR2CHTR2BHTR2ASLC6A4
SCHEMBL11327843 0.79 DRD2 (0.47) HTR2CHTR2BHTR2ASLC6A4ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021097139-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL RECURIUM IP HOLDINGS, LLC (US) 2021-05-20 WO disclosed
US-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors GENENTECH, INC. (US) 2021-02-09 US disclosed
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 US disclosed
EP-3121176-A1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY Families of Spinal Muscular Atrophy (US) 2017-01-25 EP disclosed
EP-1765810-B1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-17 EP disclosed
EP-2514748-B1 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-10 EP disclosed
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-06-02 US disclosed
EP-2755972-B1 INDANYL-SUBSTITUTED 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES, THEIR USE AS MEDICAMENT, AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM SANOFI SA (FR) 2015-10-28 EP disclosed
US-9067897-B2 2,4-Diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2015-06-30 US disclosed
US-8455500-B2 3-hydroxy-5-arylisoxazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-06-04 US disclosed
US-20110124671-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS GLAXO GROUP LIMITED (GB) 2011-05-26 US disclosed
US-20110124671-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS GLAXO GROUP LIMITED (GB) 2011-05-26 US disclosed
US-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-05-12 US disclosed
US-7888366-B2 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-02-15 US disclosed
EP-2190286-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS Glaxo Group Limited (GB) 2010-06-02 EP disclosed
WO-2009023754-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS GLAXO GROUP LIMITED (GB) 2009-02-19 WO disclosed
WO-2009023754-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS GLAXO GROUP LIMITED (GB) 2009-02-19 WO disclosed
EP-1765810-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY Decode Chemistry, Inc. (US) 2007-03-28 EP disclosed
WO-2005123724-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2005-12-29 WO disclosed
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy DECODE CHEMISTRY, INC. (US) 2005-12-29 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 (6 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-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B MAP3K14 1487/4885HTR2C 3144/4885HTR2B 3185/4885
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B MAP3K14 1487/4885HTR2C 3144/4885HTR2B 3185/4885
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy SMN1; SMN2, MUSK, MYO3B MAP3K14 1487/4885HTR2C 3144/4885HTR2B 3185/4885
US-20110124671-A1 SPIROINDENES AND SPIROINDANES AS MODULATORS OF CHEMOKINE RECEPTORS CCR2, CXCR2, CCR5 MAP3K14 1129/4885HTR2C 3356/4885HTR2B 2654/4885
US-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 MAP3K14 1555/4885HTR2C 316/4885HTR2B 374/4885
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 MAP3K14 1555/4885HTR2C 316/4885HTR2B 374/4885

“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.