SCHEMBL16076263

SCHEMBL16076263

CCn1c(=O)n(CCCO)c(=O)c2c1nc(O)n2Cc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 5/20 0.53
▸ TRPC4 Q9UBN4 2/20 0.53
▸ KCNH2 Q12809 1/20 0.53
▸ TP53 P04637 1/20 0.49
▸ TRPC1 P48995 1/20 0.49
▸ PDE5A O76074 4/20 0.48
▸ ADORA3 P0DMS8 3/20 0.48
▸ P2RX3 P56373 2/20 0.46
▸ RAB9A P51151 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 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
SCHEMBL16028059 0.90 TRPC5 (0.54) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL18834631 0.89 TRPC5 (0.53) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL18834595 0.89 TRPC5 (0.65) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16028540 0.86 TRPC5 (0.62) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16076262 0.85 TRPC5 (0.52) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16028570 0.85 TRPC5 (0.59) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16028473 0.85 TRPC5 (0.68) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16028388 0.84 TRPC5 (0.57) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16028289 0.84 TRPC5 (0.57) TRPC5TRPC4KCNH2TP53TRPC1
SCHEMBL16364001 0.84 ALDH1A1 (0.55) TRPC5TRPC4KCNH2TP53TRPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970303-B9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-09-20 — — EP disclosed
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 — — US disclosed
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 — — 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 (1 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-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885KCNH2 70/4885

“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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