SCHEMBL3081216

SCHEMBL3081216

CN=C(NC)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
GLA P06280 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
TSHR P16473 4/20 0.42
GAA P10253 3/20 0.42
TDP1 Q9NUW8 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ATM Q13315 1/20 0.37
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
CES1 P23141 2/20 0.36
MAPK1 P28482 2/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL19490643 1.00 KMT2A (0.49) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL3081213 1.00 KMT2A (0.49) KMT2AGLACACNA1BAPBA1TSHR
Hydrochloric Acid SCHEMBL1878405 0.98 KMT2A (0.47) KMT2AGLACACNA1BAPBA1TSHR
Hydrochloric Acid SCHEMBL1878404 0.98 KMT2A (0.47) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL19801364 0.82 HDAC8 (0.47) TDP1MAPT
SCHEMBL16977092 0.81 GLA (0.41) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL3773521 0.81 GAA (0.44) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL13209207 0.81 GAA (0.44) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL12116657 0.81 GAA (0.44) KMT2AGLACACNA1BAPBA1TSHR
SCHEMBL25098930 0.80 KMT2A (0.41) KMT2AGLACACNA1BAPBA1TSHR

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6433130-B1 POLYMERIZATION CATALYST; STABILITY SEKISUI CHEMICAL CO., LTD. (JP) 2002-08-13 US claimed
CN-119350433-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2025-01-24 CN disclosed
CN-112867706-B MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-11-15 CN disclosed
CN-118373875-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-07-23 CN disclosed
CN-117964684-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-05-03 CN disclosed
CN-117964683-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2024-05-03 CN disclosed
CN-112867706-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2021-05-28 CN disclosed
US-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 US disclosed
US-7789958-B2 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON (US) 2010-09-07 US disclosed
US-20090163628-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON COBALT STURGILL JEFFREY ALLEN 2009-06-25 US disclosed
WO-2004009869-A2 CORROSION-INHIBITING COATING FOR METAL SURFACES UNIVERSITY OF DAYTON (US) 2004-01-29 WO disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-6433130-B1 POLYMERIZATION CATALYST; STABILITY SEKISUI CHEMICAL CO., LTD. (JP) 2002-08-13 US disclosed
US-5387718-A Method of manufacturing alkylphenyl alkyl ethers or alkylphenyl alkyl thioethers HUELS AKTIENGESELLSCHAFT (DE) 1995-02-07 US disclosed
EP-0530454-A1 Process for the preparation of alkylphenyl alkyl ethers of alkylphenyl alkyl thioethers HÜLS AKTIENGESELLSCHAFT (DE) 1993-03-10 EP disclosed