SCHEMBL20874064

SCHEMBL20874064

CC1CN(c2ccc(N)cc2F)CCN1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.53
▸ ALDH1A1 P00352 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ GFER P55789 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CHRM4 P08173 4/20 0.44
▸ GAA P10253 1/20 0.43
▸ CHRM2 P08172 2/20 0.42
▸ CHRM1 P11229 2/20 0.42
▸ CHRM3 P20309 2/20 0.42
▸ BRD4 O60885 1/20 0.41
▸ SMARCA2 P51531 1/20 0.41
▸ SMARCA4 P51532 1/20 0.41
▸ PBRM1 Q86U86 1/20 0.41
▸ CHRM5 P08912 1/20 0.41
▸ ROCK2 O75116 2/20 0.40
▸ PRKG1 Q13976 2/20 0.40
▸ SLC6A9 P48067 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.40

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
SCHEMBL28094549 1.00 MAPT (0.53) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL20874085 0.86 ALDH1A1 (0.52) MAPTALDH1A1LMNAGFERTDP1
SCHEMBL20874039 0.86 ALDH1A1 (0.52) MAPTALDH1A1LMNAGFERTDP1
SCHEMBL20874037 0.86 ALDH1A1 (0.52) MAPTALDH1A1LMNAGFERTDP1
SCHEMBL14574753 0.84 MAPT (0.50) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL16824991 0.83 MAPT (0.55) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL13419734 0.83 MAPT (0.55) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL4816966 0.80 MAPT (0.52) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL16825000 0.78 GFER (0.50) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL18040024 0.78 GFER (0.50) MAPTALDH1A1LMNAMAPK1GFER

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-10807994-B2 Heterocyclic compounds and uses thereof NUVATION BIO INC. (US) 2020-10-20 — — US disclosed
US-20190106436-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2019-04-11 — — 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-20190106436-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 MAPT 4445/4885ALDH1A1 2869/4885LMNA 3549/4885
US-10807994-B2 Heterocyclic compounds and uses thereof WEE1, WEE2, CCNE1 MAPT 4642/4885ALDH1A1 1113/4885LMNA 3852/4885

“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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