SCHEMBL20032408

SCHEMBL20032408

CCC(CC)c1cccc2[nH]cnc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.42
BRD4 O60885 1/20 0.39
DRD4 P21917 3/20 0.38
DRD3 P35462 3/20 0.38
DRD2 P14416 2/20 0.37
DPP4 P27487 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PKM P14618 1/20 0.36
GPR84 Q9NQS5 1/20 0.34

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
SCHEMBL18713659 0.85 TSHR (0.42) PARP1BRD4DRD4DRD3DRD2
SCHEMBL2611049 0.80 PARP1 (0.46) PARP1BRD4DRD4DRD3DRD2
SCHEMBL7032508 0.77 PARP1 (0.52) PARP1
SCHEMBL24351926 0.77 PARP1 (0.44) PARP1BRD4DRD4DRD3DRD2
SCHEMBL7856459 0.77 PARP1 (0.47) PARP1BRD4DRD4DRD3DRD2
SCHEMBL2127994 0.77 HTR2A (0.47) PARP1BRD4DRD4DRD3DRD2
SCHEMBL18713775 0.76 BRD4 (0.41) PARP1BRD4DRD4DRD3DRD2
SCHEMBL2127998 0.75 PARP1 (0.41) PARP1BRD4DRD4DRD3DRD2
SCHEMBL12894974 0.74 DRD2 (0.54) PARP1BRD4DRD4DRD3DRD2
SCHEMBL29907232 0.74 DRD2 (0.54) PARP1BRD4DRD4DRD3DRD2

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-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ALTAVANT SCIENCES GMBH 2023-09-19 US disclosed
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2021-07-08 US disclosed
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES GMBH (CH) 2021-03-16 US disclosed
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ROIVANT SCIENCES GMBH (CH) 2020-07-30 US disclosed
US-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES, GmbH (CH) 2020-05-26 US disclosed
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2019-09-19 US disclosed
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES GMBH (CH) 2019-07-16 US disclosed
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2018-04-05 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 (8 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-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A PARP1 1403/4885BRD4 2241/4885DRD4 760/4885

“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.