SCHEMBL716012

SCHEMBL716012

COC[C@@H]1CCCN1c1nc2c(Cl)cccc2cc1[C@H](C)Nc1nc(C)nc(N)n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.37
ACACB O00763 6/20 0.36
ADORA2A P29274 3/20 0.35
PDE10A Q9Y233 1/20 0.35
PIK3CD O00329 3/20 0.35
ADORA1 P30542 1/20 0.34
MAP3K12 Q12852 1/20 0.34
PIK3R2 O00459 1/20 0.34
FFAR2 O15552 1/20 0.34
METAP2 P50579 1/20 0.33
SYK P43405 1/20 0.32

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
SCHEMBL715851 1.00 CRHR1 (0.37) CRHR1ACACBADORA2APDE10APIK3CD
SCHEMBL717198 0.82 ADORA2A (0.39) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL715231 0.82 ADORA2A (0.39) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL715232 0.82 ADORA2A (0.39) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL715599 0.82 ADORA2A (0.40) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL715307 0.82 ADORA2A (0.40) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL715308 0.82 ADORA2A (0.40) CRHR1ACACBADORA2APDE10AADORA1
SCHEMBL716761 0.79 PIK3CD (0.37) ACACBADORA2APIK3CDPIK3R2
SCHEMBL715637 0.79 PIK3CD (0.37) ACACBADORA2APIK3CDPIK3R2
SCHEMBL717085 0.79 ATR (0.38) PIK3CD

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
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP claimed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US claimed
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP disclosed
US-8785628-B2 Triazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-07-22 US disclosed
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2012-03-01 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 (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-20120053167-A1 Triazine Derivatives as Kinase Inhibitors MAP3K15, PI4KA, MAP3K20 CRHR1 3297/4885ACACB 1635/4885ADORA2A 2030/4885

“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.