SCHEMBL19924316

SCHEMBL19924316

CC(C)c1ccn(CI)n1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 1/20 0.30
CACNA1H O95180 1/20 0.30
CACNA1I Q9P0X4 1/20 0.30

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
SCHEMBL9967701 0.81 ALDH1A1 (0.36) CACNA1GCACNA1HCACNA1I
SCHEMBL13792445 0.81 CACNA1G (0.31) CACNA1GCACNA1HCACNA1I
SCHEMBL2186518 0.79 CACNA1G (0.33) CACNA1GCACNA1HCACNA1I
SCHEMBL16077753 0.79 CACNA1G (0.33) CACNA1GCACNA1HCACNA1I
SCHEMBL19608885 0.79 CACNA1G (0.30) CACNA1GCACNA1HCACNA1I
Hydrochloric Acid SCHEMBL27759033 0.78 CACNA1G (0.34) CACNA1GCACNA1HCACNA1I
SCHEMBL24538159 0.76
SCHEMBL15341602 0.76 KMT2A (0.34) CACNA1GCACNA1HCACNA1I
SCHEMBL22843159 0.76 MAPT (0.33) CACNA1GCACNA1HCACNA1I
SCHEMBL22927485 0.76 ADORA2A (0.31)

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-3774775-B1 4-OXO-3,4-DIHYDROQUINAZOLINE COMPOUNDS AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE UK NO 5 LTD (GB) 2023-10-11 EP disclosed
US-10316031-B2 Compositions and methods for inhibiting kinases INHIBIKASE THERAPEUTICS, INC. (US) 2019-06-11 US disclosed
US-20180057488-A1 COMPOSITIONS AND METHODS FOR INHIBITING KINASES INHIBIKASE THERAPEUTICS, INC. 2018-03-01 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-10316031-B2 Compositions and methods for inhibiting kinases MAP3K1, PACSIN2, MAP3K3 CACNA1G 4669/4885CACNA1H 4673/4885CACNA1I 4716/4885
US-20180057488-A1 COMPOSITIONS AND METHODS FOR INHIBITING KINASES MAP3K1, PACSIN2, MAP3K3 CACNA1G 4669/4885CACNA1H 4673/4885CACNA1I 4716/4885

“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.