SCHEMBL6015645

SCHEMBL6015645

CN(C)CCCNCc1ccc2[c]c[nH]c2c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.44
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
CHRM2 P08172 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 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
SCHEMBL6016037 0.82 HDAC6 (0.39) KDM4EPOLBCHRM2LMNA
SCHEMBL6015701 0.79 SMN1; SMN2 (0.42) KDM4EPOLBLMNA
SCHEMBL6016005 0.78 L3MBTL1 (0.44) KDM4EPOLBCHRM2
SCHEMBL6015885 0.75 ALDH1A1 (0.43) KDM4ESIGMAR1TSHR
SCHEMBL6015708 0.73 KDM4E (0.55) KDM4EPOLB
SCHEMBL6015768 0.71 KDM4E (0.47) KDM4E
SCHEMBL16264664 0.71 TERT (0.50) TERTCCNA2CDK2KDM4EPOLB
SCHEMBL6015755 0.71 TERT (0.46) TERTCCNA2CDK2KDM4E
SCHEMBL27208122 0.70 TDP1 (0.50) TERTCCNA2CDK2TMEM97SIGMAR1
SCHEMBL18768839 0.70 SIGMAR1 (0.60) TERTCCNA2CDK2TMEM97SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US claimed
EP-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP claimed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO claimed
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US disclosed