SCHEMBL19682347

SCHEMBL19682347

CC(Br)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HTR7 P34969 1/20 0.38
HTR2B P41595 1/20 0.38
EGFR P00533 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
RRM1 P23921 1/20 0.36
RRM2B Q7LG56 1/20 0.36
PGR P06401 1/20 0.36
MAOA P21397 1/20 0.35
ALDH1A1 P00352 4/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL1567173 0.86 NPC1 (0.47) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL6672847 0.85 PNMT (0.49) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL6675580 0.85 PNMT (0.49) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL29617348 0.85 PNMT (0.49) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL6557930 0.84 PNMT (0.47) PNMTNPC1RAB9ACYP1A2CYP3A4
Hydrochloric Acid SCHEMBL6558708 0.82 PNMT (0.46) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL7166662 0.82 PNMT (0.46) PNMTNPC1RAB9ACYP1A2CYP3A4
Hydrochloric Acid SCHEMBL6558717 0.82 PNMT (0.46) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL2231457 0.82 NPC1 (0.47) PNMTNPC1RAB9ACYP1A2CYP3A4
SCHEMBL1609628 0.82 PNMT (0.46) PNMTNPC1RAB9ACYP1A2CYP3A4

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 PNMT 4364/4885NPC1 2770/4885RAB9A 3782/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 PNMT 4364/4885NPC1 2770/4885RAB9A 3782/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 PNMT 4364/4885NPC1 2770/4885RAB9A 3782/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B PNMT 4109/4885NPC1 2311/4885RAB9A 2987/4885

“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.