SCHEMBL16301337

SCHEMBL16301337

CCc1cccc(Oc2ccncc2)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
KDM4E B2RXH2 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
TRPV6 Q9H1D0 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 1/20 0.42
GRM2 Q14416 1/20 0.41
SOD1 P00441 1/20 0.41

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
SCHEMBL30358275 0.87 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1TSHRHSD17B10
SCHEMBL9488681 0.87 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1TSHRHSD17B10
SCHEMBL5407250 0.85 KDM4E (0.58) ALDH1A1KDM4ETDP1TSHRHSD17B10
SCHEMBL11736722 0.83 ALDH1A1 (0.53) ALDH1A1KDM4ETDP1TSHRHSD17B10
SCHEMBL16301357 0.83 LMNA (0.68) ALDH1A1TDP1TRPV6LMNASMN1; SMN2
SCHEMBL100121 0.82 LOXL2 (0.52) ALDH1A1TDP1TRPV6LMNASMN1; SMN2
SCHEMBL23229951 0.81 PRMT6 (0.59) ALDH1A1KDM4ETRPV6SMN1; SMN2HTT
SCHEMBL10223958 0.81 TRPV6 (0.42) ALDH1A1KDM4ETDP1TRPV6LMNA
SCHEMBL327459 0.80 KDM4E (0.62) ALDH1A1KDM4ETDP1SMN1; SMN2HTT
SCHEMBL8243884 0.80 FFAR1 (0.51) ALDH1A1KDM4ETDP1TSHRHSD17B10

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-8148367-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-03 US disclosed
US-20100105665-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-04-29 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-20100105665-A1 RENIN INHIBITORS REN, ACE, AGT ALDH1A1 947/4885KDM4E 2733/4885TDP1 4131/4885

“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.