SCHEMBL2257660

SCHEMBL2257660

O=C(Nc1cc(-c2ccc(F)cc2)ccc1C(=O)O)c1ccc2cccc(O)c2c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 3/20 0.49
▸ HDAC2 Q92769 2/20 0.47
▸ SUCNR1 Q9BXA5 1/20 0.45
▸ PTPN11 Q06124 2/20 0.45
▸ PRSS12 P56730 2/20 0.44
▸ DHODH Q02127 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ HDAC1 Q13547 4/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ADCY8 P40145 1/20 0.42
▸ ADCY1 Q08828 1/20 0.42
▸ GRIN2D O15399 1/20 0.41
▸ GRIN2A Q12879 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ GRIN2C Q14957 1/20 0.41

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
SCHEMBL2255077 0.82 ACLY (0.52) ACLYMEN1KMT2A
SCHEMBL2257345 0.82 DHODH (0.50) ACLYHDAC2SUCNR1PTPN11PRSS12
SCHEMBL2274953 0.81 ACLY (0.67) ACLYHDAC2SUCNR1DHODHHDAC1
SCHEMBL2257897 0.81 TRPM2 (0.57) HSD17B10MEN1PKMKMT2A
SCHEMBL2256138 0.81 HCAR2 (0.59) —
SCHEMBL2257892 0.81 TRPM2 (0.57) HSD17B10MEN1PKMKMT2A
SCHEMBL2272122 0.80 DHODH (0.57) ACLYHDAC2SUCNR1DHODHHDAC1
SCHEMBL2278459 0.80 HDAC2 (0.71) ACLYHDAC2SUCNR1DHODHHDAC1
SCHEMBL2253800 0.80 ACLY (0.50) ACLYHSD17B10GRIN2DGRIN2AGRIN2B
SCHEMBL2255199 0.79 AKR1C3 (0.47) MEN1PKMKMT2AGRIN2DGRIN2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989656-B2 Biaryl carboxylic acid apoptosis promoters ABBOTT LABORATORIES (US) 2011-08-02 — — US claimed
EP-1904047-B1 APOPTOSIS PROMOTERS ABBOTT LAB (US) 2013-01-02 — — EP disclosed
US-7989656-B2 Biaryl carboxylic acid apoptosis promoters ABBOTT LABORATORIES (US) 2011-08-02 — — US disclosed
US-20100234456-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2010-09-16 — — US disclosed
US-7750004-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2010-07-06 — — US disclosed
US-20070135392-A1 Apoptosis promoters ABBVIE INC. 2007-06-14 — — 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 (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-20100234456-A1 APOPTOSIS PROMOTERS MCL1, BAX, BCL2 ACLY 2287/4885HDAC2 1085/4885SUCNR1 2479/4885
US-20070135392-A1 Apoptosis promoters MCL1, BAX, BCL2 ACLY 2287/4885HDAC2 1085/4885SUCNR1 2479/4885

“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.

Send feedback