SCHEMBL3051669

SCHEMBL3051669

CC1(C)Cc2cc(Nc3cc(C(=O)NC4CC4)ccc3Cl)ccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.52
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPK13 O15264 1/20 0.41
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL3048385 0.89 MAPK14 (0.65) MAPK14
SCHEMBL3040717 0.88 MAPK14 (0.65) MAPK14
SCHEMBL3041990 0.86 MAPK14 (0.50) MAPK14MAPTKMT2A
SCHEMBL3059142 0.83 MAPK14 (0.64) MAPK14KMT2A
SCHEMBL3050591 0.79 MAPK14 (0.68) MAPK14
SCHEMBL3049670 0.76 MAPK14 (0.59) MAPK14
SCHEMBL3061264 0.76 MAPK14 (0.48) MAPK14KDM4EMAPT
SCHEMBL4504889 0.75 MAPK14 (0.60) MAPK14CYP2C9CYP2C19
SCHEMBL3052171 0.74 MAPK14 (0.49) MAPK14CYP2C9
SCHEMBL3051455 0.73 MAPK14 (0.56) MAPK14KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222363-A1 Bicyclic Derivatives as P38 Inhibitors PALAU PHARMA, S.A. (ES) 2010-09-02 US claimed
US-20100222363-A1 Bicyclic Derivatives as P38 Inhibitors PALAU PHARMA, S.A. (ES) 2010-09-02 US 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 (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-20100222363-A1 Bicyclic Derivatives as P38 Inhibitors MAPK1, MAPKAPK2, MAPK7 MAPK14 21/4885KDM4E 3953/4885MEN1 4549/4885

“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.