SCHEMBL21164607

SCHEMBL21164607

CCC(CC)c1ccc(-c2ccc(=O)n(C)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 4/20 0.45
▸ CREBBP Q92793 7/20 0.43
▸ BRD4 O60885 5/20 0.43
▸ CYP2C19 P33261 3/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ DPP4 P27487 2/20 0.40
▸ DPP7 Q9UHL4 2/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL20032328 0.91 HSD11B1 (0.42) HSD11B1CREBBPBRD4CYP2C19CYP2C9
SCHEMBL21164449 0.85 HDAC8 (0.42) HSD11B1CREBBPBRD4CYP2C19CYP2C9
SCHEMBL18713511 0.85 CREBBP (0.46) HSD11B1CREBBPBRD4CYP2C19CYP2C9
SCHEMBL18380924 0.77 DPP4 (0.49) HSD11B1CREBBPBRD4CYP2C19DPP4
SCHEMBL16573986 0.74 BRD4 (0.50) CREBBPBRD4HRH3
SCHEMBL9919107 0.74 BRD4 (0.59) HSD11B1CREBBPBRD4
SCHEMBL21099411 0.73 NR1I2 (0.43) HSD11B1CREBBPBRD4
SCHEMBL22479536 0.73 HDAC4 (0.39) HSD11B1CREBBPBRD4
SCHEMBL18713707 0.72 BRPF1 (0.49) BRD4
SCHEMBL25258561 0.72 BRD4 (0.49) CREBBPBRD4HRH3

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 7 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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 HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HSD11B1 43/4885CREBBP 2101/4885BRD4 2241/4885

“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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