SCHEMBL24392490

SCHEMBL24392490

COc1ccc(-c2cc(C)c3c(C(C)C)ncnn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.48
▸ ALDH1A1 P00352 7/20 0.48
▸ GAA P10253 3/20 0.48
▸ EGLN2 Q96KS0 2/20 0.48
▸ HPGD P15428 4/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ STAT1 P42224 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ TSHR P16473 1/20 0.37

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
SCHEMBL24391742 0.88 KDM4E (0.44) KDM4EALDH1A1GAAEGLN2HPGD
SCHEMBL24393353 0.84 KDM4E (0.52) KDM4EALDH1A1GAAEGLN2HPGD
SCHEMBL24391766 0.73 ALDH1A1 (0.41) KDM4EALDH1A1
SCHEMBL24393093 0.72 PDE2A (0.43) KDM4EALDH1A1GAAEGLN2HPGD
SCHEMBL24391780 0.70 ACVRL1 (0.33) ALDH1A1EGLN2MAPK1TSHR
SCHEMBL24391697 0.70 ALDH1A1 (0.33) KDM4EALDH1A1
SCHEMBL24391796 0.67 EGLN2 (0.35) ALDH1A1GAAEGLN2MAPK1
SCHEMBL5447355 0.67 KDM4E (0.67) KDM4EALDH1A1GAAEGLN2HPGD
SCHEMBL24392633 0.64 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL24392134 0.64 EGLN2 (0.36) EGLN2HPGDSMN1; SMN2MEN1KMT2A

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-20220135598-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 — — 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-20220135598-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, ENPP2 KDM4E 3129/4885ALDH1A1 754/4885GAA 189/4885

“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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