SCHEMBL16355668

SCHEMBL16355668

CC(=O)c1cc2ccc(C)cc2cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.55
POLB P06746 5/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
CA9 Q16790 1/20 0.50
CYP1A2 P05177 2/20 0.48
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
CSNK2A1 P68400 1/20 0.44
HTT P42858 1/20 0.43
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
DAO P14920 2/20 0.42
DDO Q99489 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL24895084 0.85 CSNK2A1 (0.63) CYP2A6POLBKMT2AMEN1NPC1
SCHEMBL4609751 0.85 CSNK2A1 (0.63) CYP2A6POLBKMT2AMEN1NPC1
SCHEMBL9719283 0.83 CYP2A6 (0.61) CYP2A6POLBKMT2AMEN1NPC1
SCHEMBL18775431 0.81 CA12 (0.50) CYP2A6POLBKMT2AMEN1NPC1
SCHEMBL6881678 0.81 CA12 (0.50) CYP2A6POLBKMT2AMEN1NPC1
SCHEMBL30137706 0.80 MEN1 (0.58) POLBKMT2AMEN1NPC1RAB9A
SCHEMBL3893085 0.80 MEN1 (0.58) POLBKMT2AMEN1NPC1RAB9A
SCHEMBL3289428 0.80 CYP2A6 (0.68) CYP2A6KMT2AMEN1CYP1A2ALDH1A1
SCHEMBL14328979 0.78 KMT2A (0.76) POLBKMT2AMEN1NPC1RAB9A
SCHEMBL29495347 0.78 CSNK2A1 (0.69) POLBKMT2AMEN1RAB9AALDH1A1

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-9353399-B2 Two-photon absorbing compound with methods of synthesis and use POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2016-05-31 US disclosed
US-20140377791-A1 NOVEL TWO-PHOTON ABSORBING FLUORESCENT SUBSTANCE, AND SUBSTRATE SENSING METHOD USING SAME POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2014-12-25 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-20140377791-A1 NOVEL TWO-PHOTON ABSORBING FLUORESCENT SUBSTANCE, AND SUBSTRATE SENSING METHOD USING SAME MAOA, MAOB, PDE1A CYP2A6 172/4885POLB 3544/4885KMT2A 2419/4885

“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.