SCHEMBL31379800

SCHEMBL31379800

CC(C)(C)OC(=O)N1CC=C(c2ccc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)CC1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.63
BTK Q06187 7/20 0.54
GRM1 Q13255 8/20 0.51
GRM5 P41594 7/20 0.51
EGFR P00533 1/20 0.49
TEC P42680 1/20 0.49
PDE10A Q9Y233 1/20 0.46
NAMPT P43490 1/20 0.46
PDK4 Q16654 1/20 0.44

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
SCHEMBL31379801 1.00 TNK2 (0.63) TNK2BTKGRM1GRM5EGFR
SCHEMBL16597782 1.00 TNK2 (0.63) TNK2BTKGRM1GRM5EGFR
SCHEMBL16597764 0.91 TNK2 (0.54) TNK2BTKGRM1GRM5EGFR
SCHEMBL31386570 0.91 TNK2 (0.54) TNK2BTKGRM1GRM5EGFR
SCHEMBL16598127 0.90 GRM1 (0.51) TNK2BTKGRM1GRM5PDE10A
SCHEMBL31386584 0.90 GRM1 (0.51) TNK2BTKGRM1GRM5PDE10A
SCHEMBL16671349 0.89 TNK2 (0.54) TNK2BTKGRM1GRM5PDE10A
SCHEMBL16598041 0.88 BTK (0.55) TNK2BTKEGFRTEC
SCHEMBL31386629 0.86 TNK2 (0.61) TNK2BTKGRM1GRM5PDE10A
SCHEMBL16597807 0.86 TNK2 (0.61) TNK2BTKGRM1GRM5PDE10A

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-20250059176-A1 SUBSTITUTED NICOTINIMIDE INHIBITORS OF BTK FOR TREATING CANCER GUANGZHOU INNOCARE PHARMA TECH CO LTD (CN) 2025-02-20 US disclosed
US-12202813-B2 Process for preparing 6-(1-acryloylpiperidin-4-yl)-2-(4-phenoxyphenyl)nicotinamide BEIJING INNOCARE PHARMA TECH CO., LTD (CN) 2025-01-21 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-20250059176-A1 SUBSTITUTED NICOTINIMIDE INHIBITORS OF BTK FOR TREATING CANCER BTK, SYK, LYN TNK2 59/4885BTK 1/4885GRM1 2375/4885
US-12202813-B2 Process for preparing 6-(1-acryloylpiperidin-4-yl)-2-(4-phenoxyphenyl)nicotinamide NAMPT, NNT, NAPRT TNK2 829/4885BTK 3716/4885GRM1 2787/4885

“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.