SCHEMBL19958437

SCHEMBL19958437

CC(C)CCCN1CC[C@@H](O)C1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.47
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
HRH3 Q9Y5N1 6/20 0.41
HRH2 P25021 2/20 0.40
HRH1 P35367 2/20 0.40
HTR1A P08908 1/20 0.38
KCNA3 P22001 1/20 0.38

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
SCHEMBL26012973 1.00 GBA1 (0.47) GBA1PDCD1CD274HRH3HRH2
SCHEMBL17574694 1.00 GBA1 (0.47) GBA1PDCD1CD274HRH3HRH2
SCHEMBL24428913 0.94 GBA1 (0.42) GBA1PDCD1CD274HRH3HRH2
SCHEMBL11932479 0.90 GBA1 (0.49) GBA1HRH3HRH2HRH1KCNA3
SCHEMBL7375999 0.89 HTR1A (0.49) GBA1PDCD1CD274HRH3HRH2
SCHEMBL18233564 0.88 KCNA3 (0.43) GBA1PDCD1CD274HRH3HRH2
SCHEMBL8085779 0.88 KCNA3 (0.43) GBA1PDCD1CD274HRH3HRH2
SCHEMBL13519663 0.88 KCNA3 (0.43) GBA1PDCD1CD274HRH3HRH2
SCHEMBL26013893 0.84 PDCD1 (0.40) PDCD1CD274HRH3HRH2HRH1
SCHEMBL28960041 0.83 PDCD1 (0.49) PDCD1CD274HRH3HRH2HRH1

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-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE LIEBER INSTITUTE, INC. 2023-08-24 US disclosed
US-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE LIEBER INSTITUTE, INC. 2023-08-24 US disclosed
US-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF Crinetics Pharmaceuticals, Inc. 2023-05-25 US disclosed
US-10189838-B2 Aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMAN-LA ROCHE INC. (US) 2019-01-29 US disclosed
US-20180072726-A9 NOVEL AZA-OXO-INDOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2018-03-15 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-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE POLR2E, POLR2H, POLRMT GBA1 437/4885PDCD1 1338/4885CD274 3601/4885
US-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF PTH1R, CALCR, VDR GBA1 4224/4885PDCD1 4345/4885CD274 3791/4885
US-20180072726-A9 NOVEL AZA-OXO-INDOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION ZC3HAV1, IDO1, AZI2 GBA1 3512/4885PDCD1 3002/4885CD274 2912/4885
US-10189838-B2 Aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection IDO1, ZC3HAV1, AZI2 GBA1 3158/4885PDCD1 3086/4885CD274 3078/4885

“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.