SCHEMBL15577013

SCHEMBL15577013

CC1CCCc2cc(Cl)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.58
HTR2A P28223 4/20 0.58
HTR2B P41595 4/20 0.58
SLC6A4 P31645 3/20 0.44
ADRB1 P08588 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
CNR1 P21554 1/20 0.44
SLC6A2 P23975 1/20 0.44
HRH1 P35367 1/20 0.44
KCNH2 Q12809 1/20 0.44
SRD5A1 P18405 4/20 0.43
SRD5A2 P31213 2/20 0.43
KDM4C Q9H3R0 1/20 0.38
KDM1A O60341 1/20 0.38
MAP3K14 Q99558 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37

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
SCHEMBL18468830 1.00 HTR2C (0.58) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL19302170 1.00 HTR2C (0.58) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL13948529 0.89 HTR2C (0.62) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL12332825 0.89 HTR2C (0.62) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL23621912 0.84 HTR2C (0.45) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL26661698 0.82 HTR2A (0.43) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL30835166 0.81 ESR1 (0.55) HTR2BSLC6A4ESR1ESR2TSHR
SCHEMBL12401916 0.81 ESR1 (0.55) HTR2BSLC6A4ESR1ESR2TSHR
SCHEMBL5946697 0.80 HTR2C (0.58) HTR2CHTR2AHTR2BSLC6A4ADRB1
SCHEMBL5946526 0.80 HTR2C (0.58) HTR2CHTR2AHTR2BSLC6A4ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022167867-A1 SUBSTITUTED CYCLIC MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME RAPPTA THERAPEUTICS OY (FI) 2022-08-11 WO disclosed
US-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-09-28 US disclosed
EP-3816158-A1 BENZIMIDAZOLE DERIVATIVES AND USE THEREOF AS IDH1 INHIBITORS KPC Pharmaceuticals, Inc. (CN) 2021-05-05 EP disclosed
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2020-05-14 US disclosed
US-8674095-B2 Compounds for treating neuropsychiatric conditions AFRAXIS HOLDINGS, INC. (US) 2014-03-18 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-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein MCL1, BCL2A1, BCL2L1 HTR2C 4435/4885HTR2A 4416/4885HTR2B 4591/4885
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 HTR2C 4435/4885HTR2A 4416/4885HTR2B 4591/4885

“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.