SCHEMBL6341808

SCHEMBL6341808

O=C(O)c1cc(Oc2ccccc2I)cc(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.47
TTR P02766 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TPMT P51580 1/20 0.42
DHODH Q02127 2/20 0.41
FABP7 O15540 1/20 0.41
FABP3 P05413 1/20 0.41
FABP5 Q01469 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
SRD5A2 P31213 1/20 0.40
FABP1 P07148 1/20 0.39
DAO P14920 1/20 0.39
TSHR P16473 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
CTNNB1 P35222 1/20 0.39
CAMKK2 Q96RR4 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2C Q14957 1/20 0.38

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
SCHEMBL28423664 0.81 HTT (0.54) AKR1C3TTRMEN1KMT2ATSHR
SCHEMBL6340212 0.81 TTR (0.60) AKR1C3TTRMEN1KMT2AMRGPRX4
SCHEMBL6343006 0.79 AKR1C3 (0.47) AKR1C3TTRMEN1KMT2AMRGPRX4
SCHEMBL6341056 0.79 MRGPRX4 (0.55) AKR1C3TTRMEN1KMT2AMRGPRX4
SCHEMBL6341195 0.79 GAA (0.50) AKR1C3TTRMEN1KMT2ADHODH
SCHEMBL1768785 0.77 AKR1C3 (0.74) AKR1C3TTRMEN1KMT2ASRD5A2
SCHEMBL28080606 0.77 HTT (0.54) AKR1C3TTRMEN1KMT2ATSHR
SCHEMBL28264709 0.76 HTT (0.53) AKR1C3TTRMEN1KMT2ATSHR
SCHEMBL28032723 0.76 SRD5A2 (0.56) SRD5A2
SCHEMBL1195534 0.76 LCK (0.44) AKR1C3TTRMEN1KMT2AMRGPRX4

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-6949674-B2 Aromatic carboxylic acids, acid halides thereof and processes for preparing both SUMITOMO BAKELITE COMPANY, LTD. (JP) 2005-09-27 US disclosed
US-20040068139-A1 Aromatic carboxylic acids, acid halides thereof and processes for preparing both SUMITOMO BAKELITE COMPANY, LTD. (JP) 2004-04-08 US disclosed
EP-1346975-A1 AROMATIC CARBOXYLIC ACIDS, ACID HALIDES THEREOF AND PROCESSES FOR PREPARING BOTH SUMITOMO BAKELITE CO., LTD. (JP) 2003-09-24 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 (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-20040068139-A1 Aromatic carboxylic acids, acid halides thereof and processes for preparing both CCR1, CCRL2, CCR6 AKR1C3 137/4885TTR 1607/4885MEN1 4822/4885

“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.