SCHEMBL6180982

SCHEMBL6180982

CC(C(=O)Nc1n[nH]c(-c2ccc(F)c(Cl)c2)c1-c1ccncc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.49
DCAF1 Q9Y4B6 1/20 0.43
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
FAAH O00519 1/20 0.41
PSEN1 P49768 3/20 0.40
PSEN2 P49810 3/20 0.40
APH1B Q8WW43 3/20 0.40
NCSTN Q92542 3/20 0.40
APH1A Q96BI3 3/20 0.40
PSENEN Q9NZ42 3/20 0.40
CCNA2 P20248 3/20 0.38
CDK2 P24941 3/20 0.38
CCNA1 P78396 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL6177380 0.86 MAPK14 (0.65) MAPK14PSEN1PSEN2APH1BNCSTN
SCHEMBL7134695 0.81 MAPK14 (0.75) MAPK14CDK2SMN1; SMN2POLB
SCHEMBL6176683 0.77 MAPK14 (0.65) MAPK14DCAF1
SCHEMBL6178434 0.76 MAPK14 (0.67) MAPK14DCAF1LMNA
SCHEMBL6177632 0.75 MAPK14 (0.66) MAPK14CCNA2CDK2CCNA1
SCHEMBL6193980 0.75 MAPK14 (0.63) MAPK14MEN1KMT2ACCNA2CDK2
SCHEMBL6175326 0.75 MAPK14 (0.65) MAPK14DCAF1CCNA2CDK2CCNA1
SCHEMBL6178135 0.74 MAPK14 (0.64) MAPK14LMNAMAPTSMN1; SMN2POLB
SCHEMBL6176087 0.73 MAPK14 (0.63) MAPK14MEN1KMT2A
SCHEMBL6178772 0.72 MAPK14 (0.61) MAPK14DCAF1MEN1LMNAMAPT

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
CN-1326848-C Aminopyrazole derivatives TEIKOKU HORMONE MFG CO LTD (JP) 2007-07-18 CN disclosed
EP-1142890-B1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2005-08-03 EP disclosed
US-6511997-B1 For treatment of a disease associated with tumor necrosis factor alpha, interleukin 1, interleukin 6 or cyclooxygenase II; such as irritable bowel disease TEIKOKU HORMONE MFG. CO., LTD. (JP) 2003-01-28 US disclosed
CN-1331688-A Aminopyridine Derivatives TEIKOKU HORMONE MFG CO LTD (JP) 2002-01-16 CN disclosed
EP-1142890-A1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-10-10 EP disclosed