SCHEMBL22650264

SCHEMBL22650264

CC(=O)/C=C/c1ccc(C)nc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP1A2 P05177 3/20 0.45
CYP2C19 P33261 2/20 0.45
HTT P42858 1/20 0.45
IAPP P10997 2/20 0.44
TDP1 Q9NUW8 2/20 0.42
GLA P06280 1/20 0.42
KMT2A Q03164 6/20 0.42
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 3/20 0.42
ATM Q13315 1/20 0.40
PTGS1 P23219 1/20 0.38
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.35
TXNRD1 Q16881 1/20 0.35
TXNRD3 Q86VQ6 1/20 0.35
TXNRD2 Q9NNW7 1/20 0.35

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
SCHEMBL9837137 0.85 CA1 (0.44) MAPTLMNAKDM4ESMN1; SMN2HTT
SCHEMBL9837143 0.85 CA1 (0.44) MAPTLMNAKDM4ESMN1; SMN2HTT
SCHEMBL12569680 0.81 CYP1A2 (0.34) LMNAKDM4ESMN1; SMN2CYP1A2RAB9A
SCHEMBL13017801 0.78 TRPV1 (0.52) MAPTLMNAKDM4ESMN1; SMN2CYP1A2
SCHEMBL19339161 0.73 APLNR (0.50) LMNAKDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL4317195 0.72 PARP1 (0.41) LMNAKDM4ECYP1A2HTTTDP1
SCHEMBL21767548 0.70 LMNA (0.44) MAPTLMNAKDM4ESMN1; SMN2CYP1A2
SCHEMBL21767547 0.70 LMNA (0.44) MAPTLMNAKDM4ESMN1; SMN2CYP1A2
SCHEMBL29955945 0.70 CYP1A2 (0.41) MAPTLMNAKDM4ESMN1; SMN2CYP1A2
SCHEMBL1599165 0.70 CYP1A2 (0.41) MAPTLMNAKDM4ESMN1; SMN2CYP1A2

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-20200354359-A1 INHIBITING (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2020-11-12 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-20200354359-A1 INHIBITING (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV MAPT 3318/4885LMNA 2012/4885KDM4E 3490/4885

“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.