SCHEMBL23901495

SCHEMBL23901495

CCCCO[C@H]1C[C@H]2CCC[C@@H](C1)[C@H]2NC(=O)c1ncn2c(C)cc(-c3cccnc3)nc12

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.35
CRHR2 Q13324 1/20 0.35
POLB P06746 3/20 0.35
LMNA P02545 2/20 0.35
CD38 P28907 1/20 0.34
THRB P10828 1/20 0.34
WNT1 P04628 3/20 0.34
DYRK1A Q13627 3/20 0.34
NR1I2 O75469 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
SCN9A Q15858 1/20 0.33
CXCR2 P25025 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
CNR2 P34972 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
SCHEMBL19438271 0.97 CRHR1 (0.36) CRHR1CRHR2POLBLMNACD38
SCHEMBL19438269 0.97 CRHR1 (0.36) CRHR1CRHR2POLBLMNACD38
SCHEMBL19449433 0.97 CRHR1 (0.36) CRHR1CRHR2POLBLMNACD38
SCHEMBL19438270 0.97 CRHR1 (0.36) CRHR1CRHR2POLBLMNACD38
SCHEMBL23901450 0.83 HSD11B1 (0.41) CD38CNR2
SCHEMBL23901556 0.83 HSD11B1 (0.41) CD38CNR2
SCHEMBL19438251 0.82 CD38 (0.47) CRHR1CRHR2POLBLMNACD38
SCHEMBL19438252 0.82 CD38 (0.47) CRHR1CRHR2POLBLMNACD38
SCHEMBL23490715 0.82 HSD11B1 (0.35) POLBCD38TP53MAPTCNR2
SCHEMBL22472749 0.82 HSD11B1 (0.35) POLBCD38TP53MAPTCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2021-10-07 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-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, GBA2 CRHR1 3609/4885CRHR2 3728/4885POLB 495/4885

“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.