SCHEMBL3424653

SCHEMBL3424653

CC1CCN(c2c(-c3ccc(F)cc3Cl)c(Cl)nc3ncnn23)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 7/20 0.45
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 4/20 0.41
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.39
GLA P06280 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 2/20 0.37
EGLN2 Q96KS0 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL3424814 0.91 PDE2A (0.46) PDE2AMEN1GAAKMT2ALMNA
SCHEMBL3429527 0.88 PDE2A (0.42) PDE2AMEN1GAAKMT2ALMNA
SCHEMBL3423833 0.87 EGLN2 (0.42) PDE2AMEN1GAAKMT2ALMNA
SCHEMBL8917364 0.85 LMNA (0.44) PDE2AMEN1KMT2ALMNAALDH1A1
SCHEMBL4494555 0.83 CNR2 (0.39) TRPV1
SCHEMBL4817440 0.83 MAPT (0.43) MEN1GAAKMT2ALMNAALDH1A1
SCHEMBL4817257 0.83 ALDH1A1 (0.41) PDE2AGAALMNAALDH1A1TSHR
SCHEMBL81282 0.83 TSHR (0.41) PDE2AGAAKMT2ALMNAALDH1A1
SCHEMBL5593378 0.82 PDE2A (0.42) PDE2AMEN1GAAKMT2ALMNA
SCHEMBL5593427 0.81 ALDH1A1 (0.41) PDE2AGAAKMT2ALMNAALDH1A1

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-7763622-B2 Substituted 6-(2-halogennphenyl)-triazolopyrimidines BASF AKTIENGESELLSCHAFT (DE) 2010-07-27 US disclosed
CN-100537572-C 6- (2-halophenyl) -triazolopyrimidine derivatives and their use as fungicides BASF AG (DE) 2009-09-09 CN disclosed
US-20060241128-A1 Substituted 6-(2-halogennphenyl)-triazolopyrimidines BASF AKTIENGESELLSCHAFT (DE) 2006-10-26 US disclosed
CN-1751045-A 6-(2-halogenphenyl)-triazolopyrimidines derivatives and their use as fungicide BASF AG (DE) 2006-03-22 CN disclosed
EP-1562948-A2 6-(2-HALOGENPHENYL)-TRIAZOLOPYRIMIDINES DERIVATIVES AND THEIR USE AS FUNGICIDE BASF Aktiengesellschaft (DE) 2005-08-17 EP disclosed
WO-2004041824-A2 6-(2-HALOGENPHENYL)-TRIAZOLOPYRIMIDINES DERIVATIVES AND THEIR USE AS FUNGICIDE BASF AKTIENGESELLSCHAFT (DE) 2004-05-21 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-20060241128-A1 Substituted 6-(2-halogennphenyl)-triazolopyrimidines CBR3, CBR1, DCXR PDE2A 3929/4885MEN1 4790/4885GAA 2774/4885

“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.