SCHEMBL20032299

SCHEMBL20032299

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

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.61
TDP1 Q9NUW8 1/20 0.61
ALDH1A1 P00352 5/20 0.50
LMNA P02545 3/20 0.50
TSHR P16473 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSP90AA1 P07900 5/20 0.48
HSP90AB1 P08238 5/20 0.48
MAPT P10636 1/20 0.46
OPRD1 P41143 3/20 0.45
CYP1A2 P05177 1/20 0.44
BLM P54132 1/20 0.44
OPRK1 P41145 1/20 0.43
PPARG P37231 1/20 0.43

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
SCHEMBL10080951 0.85 HPGD (0.63) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL20032063 0.85 KCNA5 (0.43) HPGDTDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL27772940 0.84 HPGD (0.61) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL7406512 0.82 HPGD (0.79) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL13951835 0.80 ANPEP (0.57) HPGDALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL10250767 0.80 LMNA (0.47) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL18713522 0.80 HPGD (0.56) HPGDALDH1A1LMNASMN1; SMN2HSP90AA1
SCHEMBL12569950 0.79 KMT2A (0.47) HPGDTDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL20032296 0.78 PARP1 (0.52) TDP1TSHRMAPTBLM
SCHEMBL29737497 0.78 PARP1 (0.52) TDP1TSHRMAPTBLM

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 HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A HPGD 140/4885TDP1 1225/4885ALDH1A1 433/4885

“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.