SCHEMBL14707083

SCHEMBL14707083

c1ccc2c(c1)CCc1ccccc1N2C[C@@H]1CO1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.47
▸ SLC6A2 P23975 5/20 0.44
▸ SLC6A4 P31645 5/20 0.44
▸ CHRM2 P08172 4/20 0.44
▸ CHRM1 P11229 4/20 0.44
▸ DRD3 P35462 4/20 0.44
▸ SLC22A1 O15245 3/20 0.44
▸ CYP2D6 P10635 3/20 0.44
▸ ADRA1A P35348 3/20 0.44
▸ CACNA1B Q00975 3/20 0.44
▸ SLC6A3 Q01959 3/20 0.44
▸ KCNH2 Q12809 3/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ DRD2 P14416 3/20 0.44
▸ CHRM3 P20309 3/20 0.44
▸ HRH1 P35367 3/20 0.44
▸ SLC22A2 O15244 2/20 0.44
▸ SLC22A3 O75751 2/20 0.44
▸ ADRA2B P18089 2/20 0.44

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
SCHEMBL14707008 1.00 HTR2A (0.47) HTR2ASLC6A2SLC6A4CHRM2CHRM1
SCHEMBL7167351 1.00 HTR2A (0.47) HTR2ASLC6A2SLC6A4CHRM2CHRM1
SCHEMBL15981159 0.89 DHFR (0.41) HTR2ADRD3ADRA1ADRD2HRH1
SCHEMBL14707071 0.87 MEN1 (0.54) HTR2ASLC6A2SLC6A4CHRM2CHRM1
SCHEMBL29485914 0.87 MEN1 (0.54) HTR2ASLC6A2SLC6A4CHRM2CHRM1
SCHEMBL15985175 0.85 POLB (0.38) HTR2ASLC6A2SLC6A4CHRM2CHRM1
SCHEMBL15835892 0.80 HTR7 (0.48) DRD3DRD2HTR1ADRD4DRD5
SCHEMBL7832589 0.78 SLC6A2 (0.51) HTR2ASLC6A2SLC6A4ADRA1ASLC6A3
SCHEMBL11677590 0.77 HRH3 (0.53) SLC6A2SLC6A4CHRM2CHRM1DRD3
SCHEMBL11680549 0.77 SLC6A2 (0.53) HTR2ASLC6A2SLC6A4CHRM2CHRM1

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-20230020161-A1 Tricyclic Modulators of PP2A RAPPTA THERAPEUTICS OY (FI) 2023-01-19 — — US disclosed
US-9540358-B2 Tricyclic compounds as anticancer agents ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2017-01-10 — — US disclosed
US-9540358-B2 Tricyclic compounds as anticancer agents ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2017-01-10 — — US disclosed
US-9540358-B2 Tricyclic compounds as anticancer agents ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2017-01-10 — — US disclosed
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2014-07-31 — — US disclosed
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2014-07-31 — — US disclosed
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2014-07-31 — — US disclosed
WO-2013025882-A2 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MT. SINAI SCHOOL OF MEDICINE (US) 2013-02-21 — — 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 (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-20230020161-A1 Tricyclic Modulators of PP2A PPP2CA, PPP4C, PPP3R1 HTR2A 3250/4885SLC6A2 4125/4885SLC6A4 3675/4885
US-20140213578-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS TFEB, FOXO3, FOXO1 HTR2A 1110/4885SLC6A2 4090/4885SLC6A4 2151/4885

“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.

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