SCHEMBL18514809

SCHEMBL18514809

CCc1cc(CC)c(OCc2c(F)cccc2NC(=O)OC)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.39
NPC1 O15118 3/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
GUCY1B2 O75343 6/20 0.37
GUCY1A2 P33402 6/20 0.37
GUCY1A1 Q02108 6/20 0.37
GUCY1B1 Q02153 6/20 0.37
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
HPGD P15428 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
PTGER1 P34995 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL18749012 0.94 RAB9A (0.40) RAB9ANPC1ALDH1A1POLBGUCY1B2
SCHEMBL18514810 0.93 RAB9A (0.39) RAB9ANPC1ALDH1A1POLBGUCY1B2
SCHEMBL18513878 0.93 RAB9A (0.39) RAB9ANPC1ALDH1A1POLBGUCY1B2
SCHEMBL18514814 0.91 SLC22A12 (0.41) RAB9ANPC1ALDH1A1KDM4ESLC22A12
SCHEMBL18514787 0.90 ALDH1A1 (0.43) RAB9ANPC1ALDH1A1POLBKDM4E
SCHEMBL18514972 0.90 LMNA (0.38) RAB9ANPC1ALDH1A1POLBKMT2A
SCHEMBL18514819 0.90 HPGD (0.38) RAB9ANPC1ALDH1A1KMT2AKDM4E
SCHEMBL18514818 0.89 SLC22A12 (0.36) RAB9ANPC1ALDH1A1KDM4ENPSR1
SCHEMBL18515141 0.89 ALDH1A1 (0.43) RAB9ANPC1ALDH1A1POLBGUCY1B2
SCHEMBL18515409 0.89 ALDH1A1 (0.37) RAB9ANPC1ALDH1A1POLBGUCY1B2

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-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
EP-3130584-A1 AROMATIC COMPOUND AND USES THEREOF Sumitomo Chemical Company Limited (JP) 2017-02-15 EP 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 (2 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-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 RAB9A 143/4885NPC1 1784/4885ALDH1A1 1238/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 RAB9A 338/4885NPC1 2473/4885ALDH1A1 1416/4885

“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.