SCHEMBL6067962

SCHEMBL6067962

CC1CCN(c2c(-c3c(F)cc(C#N)cc3F)c(C#N)nc3ncnn23)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 15/20 0.48
TSHR P16473 3/20 0.39
GLA P06280 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RCE1 Q9Y256 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
SCHEMBL5462930 0.93 EGLN2 (0.44) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL4705172 0.90 EGLN2 (0.48) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL5162613 0.89 EGLN2 (0.47) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL4706706 0.87 EGLN2 (0.46) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL5593422 0.83 EGLN2 (0.41) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL5746793 0.82 EGLN2 (0.43) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL5593357 0.81 KDM1A (0.41) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL4819346 0.79 EGLN2 (0.42) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL3423833 0.79 EGLN2 (0.42) EGLN2TSHRGLANPSR1ALDH1A1
SCHEMBL5593085 0.79 EGLN2 (0.46) EGLN2TSHRGLANPSR1ALDH1A1

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-7148227-B2 Fungicidal triazolopyrimidines, methods for producing the same, use thereof for combating harmful fungi and agents containing said substances BASF AKTIENGESELLSCHAFT (DE) 2006-12-12 US disclosed
US-20050176736-A1 Fungicidal triazolopyrimidines, methods for producing the same, use thereof for combating harmful fungi and agents containing said substances BASF AKTIENGESELLSCHAFT (DE) 2005-08-11 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-20050176736-A1 Fungicidal triazolopyrimidines, methods for producing the same, use thereof for combating harmful fungi and agents containing said substances CBR1, CBR3, HAO1 EGLN2 1794/4885TSHR 2394/4885GLA 1475/4885

“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.