SCHEMBL2820132

SCHEMBL2820132

COc1ccc(Nc2cncc(-c3cccc(NC(=O)c4cccnc4Cl)c3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
MAPK1 P28482 2/20 0.53
GAA P10253 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
ALDH1A1 P00352 2/20 0.53
RAB9A P51151 1/20 0.53
XDH P47989 1/20 0.52
SLC22A12 Q96S37 1/20 0.52
POLB P06746 2/20 0.50
BRAF P15056 3/20 0.49
FYN P06241 1/20 0.49
CSF1R P07333 1/20 0.48
TOP1 P11387 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48

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
SCHEMBL2818742 0.87 SMO (0.58) MAPTMEN1KMT2AGAANPSR1
SCHEMBL2819678 0.86 MAPT (0.62) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2822758 0.83 KMT2A (0.63) MAPTMEN1KMT2AGAAALDH1A1
SCHEMBL2818641 0.82 TSHR (0.65) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL13254748 0.82 KCNK3 (0.60) MAPTMEN1KMT2AMAPK1NPSR1
SCHEMBL2822415 0.82 ADORA3 (0.61) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL2820197 0.81 ADORA3 (0.69) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL4198997 0.81 BRAF (0.72) XDHSLC22A12BRAFFYNADORA3
SCHEMBL2820201 0.80 XDH (0.47) MAPTMEN1KMT2AMAPK1GAA
SCHEMBL1499710 0.80 MAPT (0.70) MAPTMEN1KMT2AMAPK1GAA

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
US-8288421-B2 neoplastic disease, autoimmune disease, transplantation related pathology and/or degenerative disease; selectively inducing apoptosis in cancer cells BASILEA PHARMACEUTICA AG (CH) 2012-10-16 US claimed
EP-1789044-B1 PHENYLAMINOPYRIDINES AND PHENYLAMINOPYRAZINES BASILEA PHARMACEUTICA AG (CH) 2010-10-27 EP claimed
US-20080221171-A1 Phenylaminopyridines BASILEA PHARMACEUTICA AG (CH) 2008-09-11 US claimed
EP-1789044-A1 PHENYLAMINOPYRIDINES Basilea Pharmaceutica AG (CH) 2007-05-30 EP claimed
WO-2006027348-A1 PHENYLAMINOPYRIDINES BASILEA PHARMACEUTICA AG (CH) 2006-03-16 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221171-A1 Phenylaminopyridines P2RY11, BCL9, TPMT MAPT 4559/4885MEN1 2236/4885KMT2A 2811/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.