SCHEMBL24928217

SCHEMBL24928217

c1ncc2[nH]c3cc(-c4ccc5oc6cncnc6c5c4)ccc3c2n1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
MAPK14 Q16539 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
CLK2 P49760 1/20 0.30
CLK3 P49761 1/20 0.30
DYRK1A Q13627 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
SCHEMBL31485757 0.78 PLA2G2A (0.42) LMNA
SCHEMBL30460016 0.75 KDM4E (0.47) MAPTALDH1A1LMNACLK2
SCHEMBL26772813 0.73 MAPT (0.33) MAPT
SCHEMBL22249932 0.72 PIM1 (0.37) MAPTALDH1A1LMNA
SCHEMBL25490099 0.72 LIMK1 (0.34) MAPTALDH1A1LMNAKMT2A
SCHEMBL21398162 0.71 CYP1A2 (0.43) MAPTALDH1A1LMNAKMT2A
SCHEMBL16982279 0.71 PLA2G2A (0.36) MAPTALDH1A1LMNA
SCHEMBL16982261 0.71 PLA2G2A (0.33) MAPTALDH1A1LMNAKMT2AGPR55
SCHEMBL22249678 0.70 ALDH1A1 (0.61) ALDH1A1LMNAKMT2AGPR55CLK2
SCHEMBL2628321 0.70 GABRP (0.49) MAPTALDH1A1

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-20230022400-A1 IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-01-26 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-20230022400-A1 IMMUNOMODULATORS CD274, PDCD1LG2, PDCD1 MAPT 4090/4885MAPK14 2103/4885PDE3B 3998/4885

“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.