SCHEMBL31538836

SCHEMBL31538836

CN1CCC(C(=O)Oc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.55
▸ KMT2A Q03164 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ POLB P06746 2/20 0.51
▸ GAA P10253 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ SCN1A P35498 1/20 0.49
▸ SCN2A Q99250 1/20 0.49
▸ SCN3A Q9NY46 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ CHRM4 P08173 1/20 0.48
▸ CHRM5 P08912 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ CHRM3 P20309 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ TSHR P16473 1/20 0.46

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
SCHEMBL7252812 0.84 GAA (0.55) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL3193624 0.84 ELANE (0.73) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL12642500 0.84 ELANE (0.73) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL3079124 0.84 ELANE (0.73) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL12370828 0.84 ELANE (0.73) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL525974 0.84 ELANE (0.73) ELANEKMT2AHTTSMN1; SMN2TDP1
Iodide SCHEMBL30309833 0.83 SMN1; SMN2 (0.53) ELANEKMT2AHTTSMN1; SMN2TDP1
Hydrochloric Acid SCHEMBL3866426 0.82 ELANE (0.71) ELANEKMT2AHTTSMN1; SMN2TDP1
Iodide SCHEMBL30309840 0.81 KMT2A (0.51) KMT2APOLBL3MBTL1SSTR4
SCHEMBL9232274 0.80 KMT2A (0.74) ELANEKMT2AHTTSMN1; SMN2TDP1

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
CN-119661620-A Steroid compound and application thereof 润尔眼科药物(广州)有限公司 2025-03-21 — — CN disclosed
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