SCHEMBL25493745

SCHEMBL25493745

C=N/C(=C\C=C/C)c1nnc(-c2ccccn2)nn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.47
▸ KDM4E B2RXH2 9/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ LMNA P02545 5/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ HTT P42858 4/20 0.36
▸ HIF1A Q16665 5/20 0.34
▸ ALOX15 P16050 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ METAP1 P53582 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CCR1 P32246 1/20 0.33
▸ CCR5 P51681 1/20 0.33
▸ CCR8 P51685 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ DOHH Q9BU89 1/20 0.33
▸ P4HTM Q9NXG6 1/20 0.33
▸ MITF O75030 1/20 0.33

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
SCHEMBL20901312 0.87 KDM4E (0.47) TP53KDM4ETDP1HTTALOX15
SCHEMBL19101609 0.76 TSHR (0.32) KDM4ETDP1LMNASMN1; SMN2ALOX15
SCHEMBL24565502 0.76 TP53 (0.55) TP53KDM4ETDP1LMNASMN1; SMN2
SCHEMBL20903539 0.76 KDM4E (0.42) TP53KDM4ETDP1LMNASMN1; SMN2
SCHEMBL20169564 0.75 KDM4E (0.37) KDM4ETDP1LMNASMN1; SMN2HTT
SCHEMBL21128809 0.75 TP53 (0.49) TP53KDM4ETDP1LMNASMN1; SMN2
SCHEMBL22147418 0.73 CNR1 (0.37) KDM4ETDP1
SCHEMBL22650171 0.72 KDM4E (0.36) TP53KDM4ETDP1LMNASMN1; SMN2
SCHEMBL21098282 0.72 TP53 (0.49) TP53KDM4ETDP1LMNASMN1; SMN2
SCHEMBL21743331 0.71 HSP90AA1 (0.35) TP53KDM4ETDP1LMNASMN1; SMN2

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
EP-3597696-B1 RUBBER COMPOSITION FOR TIRES AND PNEUMATIC TIRE SUMITOMO RUBBER IND (JP) 2023-05-17 — — EP disclosed
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