SCHEMBL278404

SCHEMBL278404

CC(C)(C)c1cccc(OCc2cnc(Cl)s2)c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 7/20 0.70
LMNA P02545 2/20 0.70
POLB P06746 2/20 0.70
RAB9A P51151 1/20 0.70
ATM Q13315 1/20 0.70
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
TDP1 Q9NUW8 1/20 0.52
SOD1 P00441 1/20 0.48
MAPT P10636 3/20 0.46
KDM4E B2RXH2 4/20 0.45
HTT P42858 1/20 0.44
ALDH1A1 P00352 2/20 0.43
PKM P14618 1/20 0.43
PTGES2 Q9H7Z7 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
SCHEMBL278312 0.81 ALOX5 (0.48) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL13347808 0.79 L3MBTL1 (0.69) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL273137 0.75 MAOA (0.55) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL12025028 0.75 SOD1 (0.54) L3MBTL1LMNAPOLBRAB9AMEN1
SCHEMBL11125159 0.74 MAOB (0.57) MEN1KMT2ASOD1HTTPKM
SCHEMBL13761592 0.72 NR4A2 (0.56) L3MBTL1LMNAPOLBRAB9AMEN1
SCHEMBL13761587 0.72 PKM (0.68) SOD1PKM
SCHEMBL25005890 0.72 SOD1 (0.53) L3MBTL1LMNAPOLBCYP2C9CYP2C19
SCHEMBL22315220 0.72 CYP1A2 (0.71) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL12585035 0.71 MEN1 (0.76) L3MBTL1LMNAPOLBRAB9AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133898-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-13 US disclosed
US-8133898-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-13 US disclosed
US-20100137310-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-03 US disclosed
US-20100137310-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-03 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-20100137310-A1 RENIN INHIBITORS REN, ACE, PRSS3 L3MBTL1 4720/4885LMNA 1313/4885POLB 2134/4885

“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.