SCHEMBL5028533

SCHEMBL5028533

COc1c2[c]cccc2cc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR84 Q9NQS5 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41
TUBB2B Q9BVA1 1/20 0.41

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
SCHEMBL2255289 0.82 GPR84 (0.38) ERN1KDM4EGPR84TUBB4ATUBB
SCHEMBL5026835 0.79 ALDH1A1 (0.47) ERN1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL599396 0.79 ALDH1A1 (0.67) ERN1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL30949367 0.79 ALDH1A1 (0.67) ERN1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL2252754 0.79 SLC2A1 (0.40) GPR84CYP1A2
SCHEMBL476496 0.78 KDM4E (0.60) ERN1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL1556594 0.77 CYP1A2 (0.41) ALDH1A1KDM4EMAPK1HPGDCYP1A2
SCHEMBL28143357 0.74 ALOX5 (0.39) ALDH1A1KDM4EGPR84HPGDALOX5
SCHEMBL10535409 0.73 CYP2A6 (0.41) ALDH1A1KDM4EHPGDALOX5CYP1A2
SCHEMBL10523695 0.73 PTPN22 (0.41) ALDH1A1KDM4EHPGDPOLBALOX5

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1916244-B1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-12-04 EP disclosed
EP-1882694-B1 OLIGOMERS AND POLYMERS OF THIOPHENE COMPOUNDS HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-04-03 EP disclosed
EP-1916244-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-04-30 EP disclosed
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed