SCHEMBL20032501

SCHEMBL20032501

CCCC(CC)c1ccc(Cl)cc1-c1ccc(OC(C)C)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 12/20 0.38
SLC6A4 P31645 1/20 0.36
TRPV3 Q8NET8 1/20 0.36
FFAR4 Q5NUL3 4/20 0.35
CTSA P10619 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
SCHEMBL18713622 0.93 P2RX3 (0.38) P2RX3SLC6A4TRPV3FFAR4CTSA
SCHEMBL20032145 0.88 CSNK2A1 (0.40) P2RX3
SCHEMBL20032482 0.83 TRPV1 (0.36) SLC6A4CTSA
SCHEMBL18713568 0.81 CSNK2A1 (0.43) P2RX3
SCHEMBL18713738 0.81 PTGS2 (0.41) CTSA
SCHEMBL20032498 0.79 CNR1 (0.45) P2RX3TRPV3FFAR4
SCHEMBL21366928 0.79 KCNH2 (0.43)
SCHEMBL20032371 0.79 KCNH2 (0.40)
SCHEMBL18713973 0.77 KCNH2 (0.40) CTSA
SCHEMBL16574085 0.76 KCNQ3 (0.39) P2RX3TRPV3FFAR4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (2 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-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A P2RX3 1431/4885SLC6A4 19/4885TRPV3 640/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A P2RX3 1431/4885SLC6A4 19/4885TRPV3 640/4885

“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.