SCHEMBL20032324

SCHEMBL20032324

CCC(CC)c1ccc(-c2ccc(OC)c(F)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.52
FFAR1 O14842 1/20 0.52
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
TDP2 O95551 1/20 0.44
ERN1 O75460 1/20 0.43
MGLL Q99685 5/20 0.43
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PTGS2 P35354 2/20 0.41
NAAA Q02083 3/20 0.40
PTGS1 P23219 1/20 0.40
MAPT P10636 1/20 0.40
CD274 Q9NZQ7 1/20 0.40

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
SCHEMBL12189298 0.86 LMNA (0.43) CYP17A1FFAR1MEN1ALDH1A1KMT2A
SCHEMBL18713949 0.86 CYP17A1 (0.51) CYP17A1FFAR1PDGFRBPDGFRATDP2
SCHEMBL20032382 0.86 KDM1A (0.42) CYP17A1FFAR1MEN1ALDH1A1KMT2A
SCHEMBL20032120 0.85 PPARG (0.47) PDGFRBPDGFRAERN1MEN1ALDH1A1
SCHEMBL18713324 0.83 FFAR1 (0.38) CYP17A1FFAR1PDGFRBPDGFRAMEN1
SCHEMBL21508366 0.81 CYP17A1 (0.53) CYP17A1FFAR1PDGFRBPDGFRATDP2
SCHEMBL9464193 0.80 CYP17A1 (0.61) CYP17A1PDGFRBPDGFRATDP2ERN1
SCHEMBL14449509 0.78 CYP17A1 (0.65) CYP17A1FFAR1PDGFRBPDGFRATDP2
SCHEMBL20091067 0.78 CYP3A4 (0.39)
SCHEMBL20921361 0.77 TAS1R3 (0.48) FFAR1MEN1KMT2ARAB9A

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 6 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-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 (6 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 CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A CYP17A1 189/4885FFAR1 719/4885PDGFRB 372/4885

“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.