SCHEMBL4814547

SCHEMBL4814547

CC1CCN(c2c(-c3c(F)cccc3Cl)c(Cl)nc3nc(Cl)nn23)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 3/20 0.32
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
HPGD P15428 2/20 0.32
HTT P42858 2/20 0.32
NPC1 O15118 1/20 0.32
STAT6 P42226 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALOX15 P16050 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KCNH2 Q12809 1/20 0.32
GLA P06280 1/20 0.32
HSD11B1 P28845 3/20 0.32
CHRNB2 P17787 1/20 0.32

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
SCHEMBL5779311 0.85 TRPV1 (0.35) TRPV1MAPTKDM4EALDH1A1TSHR
SCHEMBL344327 0.85 TSHR (0.46) MAPTKDM4EALDH1A1TSHRLMNA
SCHEMBL5250958 0.81 TRPV1 (0.35) TRPV1MAPTKDM4EALDH1A1TSHR
SCHEMBL14500980 0.81 CDK2 (0.35) TRPV1MAPTKDM4EALDH1A1TSHR
SCHEMBL4820371 0.79 TSHR (0.48) MAPTKDM4EALDH1A1TSHRLMNA
SCHEMBL15341363 0.77 LMNA (0.43) MAPTALDH1A1TSHRLMNANPSR1
SCHEMBL4639035 0.76 GRM5 (0.34) ALDH1A1HPGDHTTSMN1; SMN2HSD17B10
SCHEMBL4818506 0.76 TSHR (0.46) MAPTALDH1A1TSHRLMNANPSR1
SCHEMBL6207550 0.75 GRM5 (0.33) ALDH1A1HSD17B10KCNH2
SCHEMBL8911791 0.75 TSHR (0.45) MAPTKDM4EALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US claimed
US-7329663-B2 Substituted-triazolopyrimidines as anticancer agents WYETH (US) 2008-02-12 US disclosed
EP-1307200-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS Wyeth (US) 2003-05-07 EP disclosed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US disclosed
WO-2002002563-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS WYETH (US) 2002-01-10 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 (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-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents TUBB3, TUBA1C, TUBB1 TRPV1 3012/4885MAPT 56/4885KDM4E 3074/4885

“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.