SCHEMBL19505522

SCHEMBL19505522

CSc1nc2c(c(=O)n(CCCO)c(=O)n2C)n1Cc1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 5/20 0.62
▸ TRPC4 Q9UBN4 2/20 0.62
▸ KCNH2 Q12809 1/20 0.62
▸ TSHR P16473 3/20 0.59
▸ ATM Q13315 1/20 0.59
▸ APOBEC3G Q9HC16 1/20 0.59
▸ TP53 P04637 2/20 0.58
▸ MAPT P10636 5/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ BRAF P15056 2/20 0.57
▸ PIK3CG P48736 1/20 0.57
▸ TRPC1 P48995 1/20 0.56
▸ HTT P42858 1/20 0.55
▸ LMNA P02545 2/20 0.52
▸ GAA P10253 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ POLB P06746 1/20 0.49

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
SCHEMBL16076233 0.90 TSHR (0.63) TRPC5TRPC4KCNH2TSHRATM
SCHEMBL19505591 0.89 ALDH1A1 (0.76) TRPC5TRPC4KCNH2TSHRATM
SCHEMBL19375018 0.88 ALDH1A1 (0.64) TRPC5TRPC4KCNH2TSHRTP53
SCHEMBL18834862 0.87 BRAF (0.63) TRPC5TRPC4KCNH2TSHRTP53
SCHEMBL18833810 0.86 TRPC5 (0.65) TRPC5TRPC4KCNH2TSHRTP53
SCHEMBL18834595 0.86 TRPC5 (0.65) TRPC5TRPC4KCNH2TSHRATM
SCHEMBL19375370 0.85 TRPC5 (0.64) TRPC5TRPC4KCNH2TSHRATM
SCHEMBL18834128 0.85 TRPC5 (0.64) TRPC5TRPC4KCNH2TSHRATM
SCHEMBL16027839 0.85 TRPC5 (0.67) TRPC5TRPC4KCNH2TSHRTP53
SCHEMBL19505260 0.84 TSHR (0.53) TRPC5TRPC4KCNH2TSHRATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230040259-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, LLC (US) 2023-02-09 — — US disclosed
US-11208409-B2 Substituted xanthines and methods of use thereof HYDRA BIOSCIENCES, LLC (US) 2021-12-28 — — US disclosed
US-20190322667-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-10-24 — — US disclosed
US-9969736-B2 Substituted xanthines and methods of use thereof HYDRA BIOSCIENCES, INC. (US) 2018-05-15 — — US disclosed
US-20170305910-A1 Substituted Xanthines and Methods of Use Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-10-26 — — 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 (4 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-20230040259-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885KCNH2 70/4885
US-20170305910-A1 Substituted Xanthines and Methods of Use Thereof TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885KCNH2 70/4885
US-11208409-B2 Substituted xanthines and methods of use thereof TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885KCNH2 70/4885
US-20190322667-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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