SCHEMBL4669767

SCHEMBL4669767

CC(c1ccccc1)c1ccc(N(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
TSHR P16473 4/20 0.50
HSD17B10 Q99714 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
RELA Q04206 1/20 0.48
RAB9A P51151 2/20 0.45
HPGD P15428 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
PHLPP2 Q6ZVD8 1/20 0.44
SLC2A1 P11166 1/20 0.44

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
SCHEMBL10145543 0.91 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL3893552 0.91 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL17754486 0.84 NR3C2 (0.43) ALDH1A1KDM4EMAPK1TDP1HPGD
SCHEMBL7110610 0.84 SLC2A1 (0.61) ALDH1A1TSHRHSD17B10KDM4EALOX15
SCHEMBL61350 0.84 SLC2A1 (0.61) ALDH1A1TSHRHSD17B10KDM4EALOX15
SCHEMBL8643448 0.83 ESR1 (0.55) ALDH1A1TSHRKDM4EKMT2A
SCHEMBL10116476 0.82 ALDH1A1 (0.68) ALDH1A1TSHRHSD17B10KDM4EALOX15
SCHEMBL9180847 0.82 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10KDM4EALOX15
Water SCHEMBL10498815 0.82 SLC2A1 (0.59) ALDH1A1TSHRHSD17B10KDM4EALOX15
SCHEMBL10162929 0.82 NR3C2 (0.44) ALDH1A1KDM4EMAPK1TDP1RELA

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-20080221369-A1 Process for the preparation of substituted phenols DAICEL CHEMICAL INSDUSTRIES, LTD. (JP) 2008-09-11 US disclosed
EP-1967505-A1 Process for the preparation of substituted phenols Daicel Chemical Industries, Ltd. (JP) 2008-09-10 EP disclosed
US-5081191-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1992-01-14 US disclosed
US-4975491-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1990-12-04 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-20080221369-A1 Process for the preparation of substituted phenols CYP1A1, NOX1, ROS1 ALDH1A1 308/4885TSHR 3848/4885HSD17B10 647/4885

“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.