SCHEMBL30824500

SCHEMBL30824500

c1cc2ccc(N3CCOCC3)cc2cn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 1/20 0.55
▸ MAPT P10636 5/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ HTT P42858 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ NSD2 O96028 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ CASP1 P29466 1/20 0.51
▸ CASP7 P55210 1/20 0.51
▸ CASP6 P55212 1/20 0.51
▸ MAPK14 Q16539 1/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ RPS6KA2 Q15349 1/20 0.47
▸ RPS6KA1 Q15418 1/20 0.47
▸ AKR1C3 P42330 1/20 0.47
▸ TP53 P04637 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ LGMN Q99538 1/20 0.45

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
SCHEMBL2419422 0.81 HTR3E (0.63) RPS6KA3
SCHEMBL30738297 0.78 CYP19A1 (0.54) MAPK10MAPTKDM4EMAPK1CCNC
SCHEMBL15516206 0.78 CYP19A1 (0.54) MAPK10MAPTKDM4EMAPK1CCNC
SCHEMBL4745958 0.78 AKR1C3 (0.69) MAPTKDM4EHTTSMN1; SMN2NSD2
SCHEMBL8871292 0.75 PRKDC (0.50) MAPK10MAPTKDM4EHTTSMN1; SMN2
SCHEMBL31302322 0.75 PRKDC (0.53) MAPK10MAPTKDM4EHTTSMN1; SMN2
SCHEMBL2419166 0.75 PRKDC (0.53) MAPK10MAPTKDM4EHTTSMN1; SMN2
SCHEMBL49166 0.74 CHKA (0.67) MAPTKDM4EHTTLMNATP53
SCHEMBL6017418 0.74 HTR3E (0.63) RPS6KA3
SCHEMBL17120694 0.74 KDM4E (0.61) MAPK10MAPTKDM4EHTTSMN1; SMN2

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-20240067632-A1 WEE1 Degrading Compounds and Uses Thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2024-02-29 — — 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-20240067632-A1 WEE1 Degrading Compounds and Uses Thereof WEE1, WEE2, PPME1 MAPK10 1388/4885MAPT 2871/4885KDM4E 376/4885

“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.

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