SCHEMBL20032411

SCHEMBL20032411

CCC(CC)c1cccc(C(=O)NC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
SLC7A5 Q01650 1/20 0.49
ROCK2 O75116 2/20 0.48
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PLK1 P53350 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PRSS1 P07477 1/20 0.42
CREBBP Q92793 1/20 0.42
ATM Q13315 1/20 0.42
TP53BP1 Q12888 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
KIF11 P52732 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL18175876 0.87 HDAC8 (0.45) HDAC8HDAC6SLC7A5ROCK2GAA
SCHEMBL14108019 0.85 HDAC8 (0.53) HDAC8HDAC6SLC7A5ROCK2GAA
Ethane SCHEMBL27914659 0.85 HDAC8 (0.63) HDAC8HDAC6HSD17B10ALDH1A1
SCHEMBL14983606 0.83 HDAC8 (0.50) HDAC8HDAC6SLC7A5ROCK2GAA
SCHEMBL12829992 0.83 L3MBTL1 (0.63) HDAC8HDAC6ROCK2GAAKMT2A
SCHEMBL276759 0.81 HDAC8 (0.59) HDAC8HDAC6SLC7A5ROCK2GAA
SCHEMBL13951835 0.81 ANPEP (0.57) KMT2AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL10250767 0.81 LMNA (0.47) HDAC8HDAC6KMT2AHSD17B10ALDH1A1
SCHEMBL20032090 0.80 LOXL2 (0.53) SLC7A5KMT2AALDH1A1F2F10
SCHEMBL2426452 0.79 HDAC8 (0.58) HDAC8HDAC6SLC7A5ROCK2GAA

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-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 (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 HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HDAC8 1335/4885HDAC6 2031/4885SLC7A5 323/4885

“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.