SCHEMBL19682797

SCHEMBL19682797

Cc1cccc(C(C)Br)c1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.39
TSHR P16473 4/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
GABRA1 P14867 3/20 0.38
CYP1A2 P05177 3/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
LMNA P02545 2/20 0.38
CYP3A4 P08684 2/20 0.38
GABRB2 P47870 2/20 0.38
SLC6A2 P23975 2/20 0.38
FAAH O00519 1/20 0.38
HPGD P15428 1/20 0.38
GABRB1 P18505 1/20 0.38
PTGS1 P23219 1/20 0.38
HTR2C P28335 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
HTR2B P41595 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
SCHEMBL11859274 0.89 P2RX7 (0.40) P2RX7TSHRCA1CA2GABRA1
SCHEMBL825972 0.84 TSHR (0.48) TSHRCA1CA2GABRA1CYP1A2
Hydrogen Peroxide SCHEMBL8443355 0.80 GABRA1 (0.50) TSHRCA1CA2GABRA1CYP1A2
SCHEMBL11860183 0.79 CA1 (0.46) TSHRCA1CA2CYP1A2LMNA
SCHEMBL1415336 0.79 P2RX7 (0.45) P2RX7TSHRCA1CA2GABRA1
SCHEMBL598366 0.78 CA1 (0.50) TSHRCA1CA2GABRA1CYP1A2
SCHEMBL11856417 0.77 TSHR (0.46) P2RX7TSHRCA1CA2GABRA1
Carbimide SCHEMBL28720207 0.77 GABRA1 (0.41) TSHRCA1CA2GABRA1CYP1A2
SCHEMBL624799 0.77 ESR1 (0.52) P2RX7TSHRCA1CA2GABRA1
SCHEMBL16308863 0.77 ESR1 (0.52) P2RX7TSHRCA1CA2GABRA1

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 P2RX7 3672/4885TSHR 840/4885CA1 2108/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 P2RX7 3672/4885TSHR 840/4885CA1 2108/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 P2RX7 3672/4885TSHR 840/4885CA1 2108/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B P2RX7 3886/4885TSHR 284/4885CA1 1628/4885

“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.