SCHEMBL3471236

SCHEMBL3471236

COc1cc2c(OC)c(-c3c(C)cc4c(C(=O)NCCc5cccc(C)c5)c(OC)c(OC)cc4c3OC)c(C)cc2c(C(=O)NCCc2cccc(C)c2)c1OC

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
TAAR1 Q96RJ0 1/20 0.49
BCL2 P10415 2/20 0.48
BCL2L1 Q07817 2/20 0.48
MCL1 Q07820 2/20 0.48
BCL2A1 Q16548 1/20 0.47
ALDH1A1 P00352 5/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
THRB P10828 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
ALOX12 P18054 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
SCHEMBL3472763 0.91 TAAR1 (0.58) MAPTTAAR1BCL2BCL2L1MCL1
SCHEMBL3473276 0.90 ADORA2A (0.49) MAPTALDH1A1LMNA
SCHEMBL9312511 0.79 MAPT (0.62) MAPTALDH1A1NPC1RAB9AMEN1
SCHEMBL3471960 0.76 BCL2 (0.55) MAPTBCL2BCL2L1MCL1ALDH1A1
SCHEMBL12239054 0.74 BCL2L1 (0.81) BCL2BCL2L1MCL1BCL2A1NPC1
SCHEMBL3471000 0.74 BCL2 (0.59) MAPTBCL2BCL2L1MCL1BCL2A1
SCHEMBL3265536 0.74 BCL2 (0.59) MAPTBCL2BCL2L1MCL1BCL2A1
SCHEMBL9311916 0.72 NPC1 (0.77) MAPTALDH1A1NPC1RAB9AMEN1
SCHEMBL353909 0.71 MEN1 (0.43) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL9848120 0.69 ALDH1A1 (0.72) MAPTALDH1A1NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2418942-B1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS SANFORD-BURNHAM MEDICAL RES INST (US) 2017-08-23 EP disclosed
US-8436207-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2013-05-07 US disclosed
US-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-10-21 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-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS HAX1, BAX, APOL1 MAPT 4063/4885TAAR1 4231/4885BCL2 11/4885

“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.