SCHEMBL5350341

SCHEMBL5350341

Cc1cn(C)c(C)c1C(=O)C=CN(C)C

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.49
TDP1 Q9NUW8 1/20 0.46
RECQL P46063 2/20 0.42
ALDH1A1 P00352 7/20 0.42
RAB9A P51151 5/20 0.42
KMT2A Q03164 4/20 0.42
LMNA P02545 3/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 6/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 3/20 0.39
KDM4E B2RXH2 2/20 0.37
GAA P10253 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
SCHEMBL14423764 1.00 POLB (0.49) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL6968501 0.72 TP53 (0.32) POLBCYP2C19KDM4E
SCHEMBL15572999 0.72 POLB (0.54) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL15572997 0.72 POLB (0.54) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL9959156 0.70 TP53 (0.40) POLBTDP1RECQLALDH1A1LMNA
SCHEMBL5201884 0.70 KDM4E (0.39) POLBALDH1A1KMT2ALMNAMEN1
SCHEMBL15340726 0.69 MAPT (0.44) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL15328868 0.69 MAPT (0.44) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL28280222 0.69 POLB (0.38) POLBTDP1RECQLALDH1A1RAB9A
SCHEMBL9656843 0.68 GABRR1 (0.31) RAB9ALMNAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262202-B2 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-28 US disclosed
US-20070185134-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-09 US disclosed
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2004-07-08 US disclosed
CN-1503794-A Inhiitors of cyclin dependent kinases as anti-cancer agent 2004-06-09 CN disclosed
EP-1373253-A1 INHIBITORS OF CYCLIN DEPENDENT KINASES AS ANTI-CANCER AGENT Cyclacel Limited (GB) 2004-01-02 EP disclosed
WO-2002079193-A1 INHIBITORS OF CYCLIN DEPENDENT KINASES AS ANTI-CANCER AGENT CYCLACEL LIMITED (GB) 2002-10-10 WO disclosed

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

For each of this compound's patents that has machine-readable text (2 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-20070185134-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CDK2, CCNK, CDK3 POLB 250/4885TDP1 1291/4885RECQL 1628/4885
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CDK2, CCNK, CDK3 POLB 250/4885TDP1 1291/4885RECQL 1628/4885

“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.