SCHEMBL14033387

SCHEMBL14033387

Cc1c(Cc2cccc(C(F)(F)F)c2)cnc2c(C(=O)NCCOCCO)cnn12

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 11/20 0.49
HTR2B P41595 1/20 0.49
CCR1 P32246 5/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HSP90AA1 P07900 1/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
BRAF P15056 1/20 0.42

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
SCHEMBL14033903 0.87 ALDH1A1 (0.49) GPR52KDM4EMAPTALDH1A1
SCHEMBL14033045 0.83 PDE2A (0.41) GPR52KDM4EMAPTALDH1A1POLB
SCHEMBL14033204 0.82 KDM4E (0.45) GPR52HTR2BCCR1KDM4EALDH1A1
SCHEMBL4439055 0.80 BRAF (0.54) KDM4EMAPTALDH1A1BRAF
SCHEMBL4725426 0.76 RUVBL1 (0.57) NPSR1KDM4EMAPTALDH1A1
SCHEMBL14033657 0.75 GPR52 (0.49) GPR52KDM4EALDH1A1BRAF
SCHEMBL4781535 0.74 KDM4E (0.58) GPR52NPSR1KDM4EMAPTALDH1A1
SCHEMBL4725875 0.73 LMNA (0.56) NPSR1KDM4EMAPTALDH1A1POLB
SCHEMBL14033910 0.71 RIPK1 (0.44) NPSR1KDM4EMAPTALDH1A1POLB
SCHEMBL14033041 0.71 KDM5A (0.46) GPR52KDM4EALDH1A1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 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 (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-20080255153-A1 New compounds SCD, SCD5, FADS2 GPR52 1409/4885HTR2B 4619/4885CCR1 1615/4885

“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.