SCHEMBL9900316

SCHEMBL9900316

CC(C)(C)c1ccc(-c2ccc3c(c2)C(C)(C)c2cc(O)c4ccccc4c2-3)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 1/20 0.38
NR2F2 P24468 1/20 0.38
RAB9A P51151 1/20 0.38
GPR84 Q9NQS5 1/20 0.36
HSD17B2 P37059 1/20 0.36
CNR1 P21554 4/20 0.36
CNR2 P34972 3/20 0.36
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
PDK2 Q15119 3/20 0.33
ASIC1 P78348 1/20 0.33
PSD A5PKW4 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.32
GAA P10253 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
SCHEMBL161727 0.88 ALOX5 (0.39) KMT2AMEN1HSP90AA1PDK2ALDH1A1
SCHEMBL8509708 0.83 CNR1 (0.35) KMT2AMEN1NPC1NR2F2RAB9A
SCHEMBL30125445 0.83 CNR1 (0.35) KMT2AMEN1NPC1NR2F2RAB9A
SCHEMBL1814886 0.82 PDK2 (0.46) KMT2AMEN1NPC1RAB9AGPR84
SCHEMBL1812126 0.82 GPR84 (0.36) KMT2AMEN1NPC1RAB9AGPR84
SCHEMBL2630542 0.77 RAB9A (0.40) KMT2AMEN1NPC1RAB9ACNR1
SCHEMBL21085246 0.77 PDK2 (0.46) KMT2AMEN1NPC1NR2F2RAB9A
SCHEMBL23572608 0.77 MAPT (0.36) KMT2AMEN1HSD17B2HSP90AA1PDK2
SCHEMBL1812200 0.77 PDK2 (0.48) HSP90AA1PDK2ALDH1A1KDM4E
SCHEMBL30104205 0.77 MAPT (0.36) KMT2AMEN1HSD17B2HSP90AA1PDK2

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
US-9028728-B2 Photochromic materials that include indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
WO-2013086248-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 2013-06-13 WO disclosed
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 KMT2A 1529/4885MEN1 4483/4885NPC1 3418/4885

“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.