SCHEMBL19682603

SCHEMBL19682603

Cc1ccc2ccccc2c1[C@@H](C)[C@H](N)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 3/20 0.42
SLC1A2 P43004 3/20 0.42
SLC1A1 P43005 3/20 0.42
TSHR P16473 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
AKR1B1 P15121 2/20 0.40
ACP3 P15309 1/20 0.40
NCEH1 Q6PIU2 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PRNP P04156 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
WDR5 P61964 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL20889376 1.00 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1TSHRCYP1A2
SCHEMBL29628799 0.84 AKR1C3 (0.42) SLC1A3SLC1A2SLC1A1AKR1B1NCEH1
SCHEMBL20889374 0.84 AKR1C3 (0.42) SLC1A3SLC1A2SLC1A1AKR1B1NCEH1
SCHEMBL19682748 0.84 AKR1C3 (0.42) SLC1A3SLC1A2SLC1A1AKR1B1NCEH1
SCHEMBL13465324 0.81 AKR1B1 (0.51) TSHRCYP1A2CYP2A6AKR1B1ACP3
SCHEMBL2440482 0.77 TSHR (0.52) TSHRCYP1A2CYP2A6ACP3NCEH1
Hydrogen Peroxide SCHEMBL8610674 0.77 CYP1A2 (0.52) TSHRCYP1A2CYP2A6AKR1B1ACP3
SCHEMBL19682744 0.76 SLC1A3 (0.48) SLC1A3SLC1A2SLC1A1CYP1A2ALDH1A1
SCHEMBL7366366 0.76 SLC1A3 (0.48) SLC1A3SLC1A2SLC1A1CYP1A2ALDH1A1
SCHEMBL29628527 0.76 SLC1A3 (0.48) SLC1A3SLC1A2SLC1A1CYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10889555-B2 Sulfonamide compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-01-12 US disclosed
US-20200405697-A1 Antitumor Agent TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-12-31 US disclosed
US-20200399235-A1 Sulfonamide Compound or Salt Thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-12-24 US disclosed
EP-3718545-A1 ANTITUMOR AGENT Taiho Pharmaceutical Co., Ltd. (JP) 2020-10-07 EP disclosed
US-20200157066-A1 Sulfonamide Compound or Salt Thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-05-21 US disclosed
EP-3466934-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2019-04-10 EP disclosed
WO-2017209155-A1 SULFONAMIDE COMPOUND OR SALT THEREOF 大鵬薬品工業株式会社 2017-12-07 WO 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 (4 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-20200399235-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 SLC1A3 3645/4885SLC1A2 4159/4885SLC1A1 3403/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 SLC1A3 3645/4885SLC1A2 4159/4885SLC1A1 3403/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 SLC1A3 3645/4885SLC1A2 4159/4885SLC1A1 3403/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B SLC1A3 3275/4885SLC1A2 4106/4885SLC1A1 3066/4885

“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.