SCHEMBL7817360

SCHEMBL7817360

Cn1cc(-c2nc3ccccc3n(C)c2=O)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 13/20 0.62
▸ CYP1A2 P05177 12/20 0.62
▸ USP2 O75604 11/20 0.62
▸ MEN1 O00255 11/20 0.62
▸ KMT2A Q03164 11/20 0.62
▸ ALDH1A1 P00352 8/20 0.62
▸ CYP2C19 P33261 6/20 0.62
▸ MAPT P10636 4/20 0.62
▸ KDM4E B2RXH2 2/20 0.60
▸ HPGD P15428 2/20 0.60
▸ GAA P10253 1/20 0.60
▸ CYP2C9 P11712 9/20 0.60
▸ CASP1 P29466 7/20 0.60
▸ CASP7 P55210 6/20 0.60
▸ HIF1A Q16665 4/20 0.60
▸ LMNA P02545 4/20 0.60
▸ HSD17B10 Q99714 3/20 0.60
▸ ALOX15 P16050 2/20 0.60
▸ CYP2D6 P10635 2/20 0.60
▸ PKM P14618 1/20 0.59

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
SCHEMBL28694505 0.81 MAPT (0.68) USP2MEN1KMT2AALDH1A1MAPT
Isocryptolepine SCHEMBL29349681 0.79 ALDH1A1 (0.54) CYP3A4CYP1A2USP2MEN1KMT2A
Isocryptolepine SCHEMBL9390637 0.79 ALDH1A1 (0.54) CYP3A4CYP1A2USP2MEN1KMT2A
SCHEMBL7815250 0.78 MAPT (0.54) CYP3A4CYP1A2USP2MEN1KMT2A
SCHEMBL31448409 0.78 MAPT (0.71) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL7815125 0.77 RAB9A (0.67) CYP3A4CYP1A2USP2MEN1KMT2A
SCHEMBL19448879 0.77 MAPT (1.00) MEN1KMT2AALDH1A1MAPTKDM4E
Acetic Acid SCHEMBL7815108 0.76 CAMK2D (0.51) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL14006985 0.75 ALDH1A1 (1.00) CYP3A4CYP1A2USP2MEN1KMT2A
SCHEMBL30139977 0.73 KDM4E (0.82) MEN1KMT2AALDH1A1MAPTKDM4E

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-20010025043-A1 New pharmaceutical active compounds ASTRA AKTIEBOLAG, A SWEDEN CORPORATION 2001-09-27 — — US disclosed
US-6271231-B1 Pharmaceutically active compounds ASTRA AKTIEBOLAG (SE) 2001-08-07 — — 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-20010025043-A1 New pharmaceutical active compounds CSNK1A1, CSNK1G1, CSNK2A1 CYP3A4 790/4885CYP1A2 477/4885USP2 4177/4885

“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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