SCHEMBL30444641

SCHEMBL30444641

O=CCC1(N2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ LMNA P02545 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GLS O94925 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ MC4R P32245 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ POLB P06746 1/20 0.34

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
SCHEMBL25464698 1.00 ALDH1A1 (0.38) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL22813353 0.77 ALDH1A1 (0.42) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL25174808 0.74 ALDH1A1 (0.40) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL2146868 0.73 ALDH1A1 (0.39) ALDH1A1LMNACYP1A2MEN1KMT2A
SCHEMBL14191432 0.69 LMNA (0.46) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL1846229 0.68 LMNA (0.51) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL17033019 0.68 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP2C9CYP2C19HPGD
SCHEMBL29986630 0.67 ALDH1A1 (0.38) ALDH1A1LMNACA12CA9MEN1
SCHEMBL27189958 0.67 ALDH1A1 (0.38) ALDH1A1LMNACA12CA9MEN1
SCHEMBL29529168 0.66 CASP3 (0.58) ALDH1A1CA12CA9MEN1KMT2A

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
EP-4408847-A1 IMIDAZOPYRIDAZINE IL-17 INHIBITOR COMPOUNDS Janssen Pharmaceutica NV (BE) 2024-08-07 — — EP disclosed
WO-2023049887-A1 IMIDAZOPYRIDAZINE IL-17 INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 — — WO disclosed
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