SCHEMBL20182563

SCHEMBL20182563

Cc1cnccc1CCc1cnn(CC2CC2)c1C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
CRHR1 P34998 1/20 0.34
ADAMTS4 O75173 1/20 0.33
KCNH2 Q12809 1/20 0.33
DYRK1A Q13627 1/20 0.33
OPRL1 P41146 2/20 0.33
KDM4C Q9H3R0 1/20 0.33
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 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
SCHEMBL18256013 0.72 CRHR1 (0.46) LMNACRHR1ALDH1A1L3MBTL1MAPT
SCHEMBL22087276 0.71 OPRL1 (0.40) LMNAKCNH2DYRK1AOPRL1
SCHEMBL29535732 0.68 SPHK1 (0.33) LMNACRHR1ALDH1A1L3MBTL1MAPT
SCHEMBL17076641 0.66 PKM (0.43) LMNACRHR1ALDH1A1L3MBTL1MAPT
SCHEMBL18924363 0.66 TDP1 (0.43) LMNAKDM4CALDH1A1L3MBTL1MAPT
SCHEMBL21983945 0.66 TAAR1 (0.50) ALDH1A1
SCHEMBL19222887 0.65 PKM (0.49) LMNACRHR1MAPT
SCHEMBL873728 0.65 CYP2E1 (0.49) KDM4CL3MBTL1
SCHEMBL14945019 0.64 TAAR1 (0.52)
SCHEMBL6628774 0.64 TKT (0.39) ALDH1A1

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-10278973-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-05-07 US disclosed
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-24 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-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A LMNA 2317/4885CRHR1 2706/4885ADAMTS4 931/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A LMNA 2317/4885CRHR1 2706/4885ADAMTS4 931/4885

“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.