SCHEMBL19682353

SCHEMBL19682353

Cc1c(-c2ccccc2)cccc1C(C)Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 7/20 0.47
PDCD1 Q15116 6/20 0.47
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.39
P2RX7 Q99572 1/20 0.36
ADRA2A P08913 1/20 0.35
HTR7 P34969 1/20 0.35
ADRA1A P35348 1/20 0.35
HSD17B10 Q99714 2/20 0.34
CYP2A6 P11509 2/20 0.34
HPGD P15428 1/20 0.34
BCL2L1 Q07817 1/20 0.34
CYP2B6 P20813 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
USP1 O94782 1/20 0.33

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
SCHEMBL6318808 0.84 PDCD1 (0.50) CD274PDCD1ALDH1A1HPGDCA12
SCHEMBL4588816 0.84 ALDH1A1 (0.44) CD274PDCD1ALDH1A1MAPK1P2RX7
SCHEMBL6281487 0.81 CD274 (0.47) CD274PDCD1ALDH1A1MAPK1ADRA2A
SCHEMBL28811025 0.81 ALDH1A1 (0.39) CD274PDCD1ALDH1A1MAPK1P2RX7
SCHEMBL27385704 0.81 ALDH1A1 (0.39) CD274PDCD1ALDH1A1MAPK1P2RX7
SCHEMBL11863728 0.79 P2RX7 (0.45) ALDH1A1P2RX7ADRA2AHTR7ADRA1A
SCHEMBL20817177 0.78 PDCD1 (0.48) CD274PDCD1ALDH1A1MAPK1ADRA2A
SCHEMBL11060981 0.78 MEN1 (0.45) CD274PDCD1ALDH1A1ADRA2AHTR7
SCHEMBL8679258 0.78 CD274 (0.49) CD274PDCD1
SCHEMBL25785668 0.76 PDCD1 (0.64) CD274PDCD1ALDH1A1MAPK1ADRA2A

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 CD274 4785/4885PDCD1 4563/4885ALDH1A1 1103/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 CD274 4785/4885PDCD1 4563/4885ALDH1A1 1103/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 CD274 4785/4885PDCD1 4563/4885ALDH1A1 1103/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B CD274 3272/4885PDCD1 2689/4885ALDH1A1 1397/4885

“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.