SCHEMBL27442555

SCHEMBL27442555

NNC(=O)c1ccccc1Cn1nnc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 1/20 0.59
▸ KDM4E B2RXH2 3/20 0.58
▸ MAPT P10636 2/20 0.58
▸ LMNA P02545 2/20 0.53
▸ TP53 P04637 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ MGAM O43451 3/20 0.51
▸ AMY1A P0DUB6 3/20 0.51
▸ GAA P10253 3/20 0.51
▸ SI P14410 3/20 0.51
▸ MGAM2 Q2M2H8 3/20 0.51
▸ SLC9A1 P19634 2/20 0.50
▸ GRM2 Q14416 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ EGLN3 Q9H6Z9 1/20 0.49
▸ RAB9A P51151 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.47

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
SCHEMBL3552907 0.78 KCNMA1 (0.67) KCNMA1MAPTLMNATP53KMT2A
SCHEMBL2490338 0.73 KDM4E (1.00) KDM4EMAPTLMNAKMT2AALDH1A1
SCHEMBL2070662 0.73 GAA (0.67) KDM4EMAPTTP53KMT2AMGAM
SCHEMBL9303187 0.72 KCNMA1 (0.67) KCNMA1MAPTLMNATP53KMT2A
SCHEMBL14848341 0.72 MGAM (0.49) KCNMA1KDM4EMAPTLMNAALDH1A1
SCHEMBL3878065 0.71 KCNMA1 (0.80) KCNMA1LMNATP53KMT2AALDH1A1
SCHEMBL14376781 0.70 GRM2 (0.61) KDM4ELMNATP53MGAMAMY1A
SCHEMBL9302790 0.70 HPGD (1.00) KCNMA1KDM4EMAPTLMNATP53
SCHEMBL688425 0.70 KDM4E (0.57) KDM4EMAPTKMT2AALDH1A1MGAM
SCHEMBL579871 0.69 RPS6KA3 (0.59) KDM4EMAPTKMT2AALDH1A1MGAM

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
CN-1118797-A Embossing inhibitor ARMSTRONG WORLD IND INC (US) 1996-03-20 — — CN claimed
CN-1118797-A Embossing inhibitor ARMSTRONG WORLD IND INC (US) 1996-03-20 — — CN disclosed
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