SCHEMBL4455674

SCHEMBL4455674

CC(Br)c1cccc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.44
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43
BCHE P06276 1/20 0.35
CYP1A2 P05177 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
CYP3A4 P08684 2/20 0.34
FAAH O00519 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
GABRB1 P18505 1/20 0.34
PTGS1 P23219 1/20 0.34
SLC6A2 P23975 1/20 0.34
HTR2C P28335 1/20 0.34
GABRA5 P31644 1/20 0.34

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
SCHEMBL30846952 1.00 P2RX7 (0.44) P2RX7CES2CES1BCHECYP1A2
SCHEMBL30846983 0.81 P2RX7 (0.42) P2RX7CES2CES1GABRA1CYP3A4
SCHEMBL626283 0.81 P2RX7 (0.42) P2RX7CES2CES1GABRA1CYP3A4
SCHEMBL420964 0.81 GABRA1 (0.48) CES2CES1BCHECYP1A2GABRA1
SCHEMBL3310094 0.81 CES2 (0.46) P2RX7CES2CES1BCHECYP1A2
SCHEMBL19682802 0.80 P2RX7 (0.43) P2RX7CYP1A2GABRA1GABRG2GABRB3
SCHEMBL19682806 0.80 P2RX7 (0.43) P2RX7CES2CES1CYP1A2GABRA1
SCHEMBL1600457 0.79 CES2 (0.44) CES2CES1BCHECYP1A2SLC6A2
SCHEMBL22904307 0.78 P2RX7 (0.50) P2RX7CYP1A2GABRA1GABRG2GABRB3
SCHEMBL19682350 0.78 P2RX7 (0.42) P2RX7CES2CES1CYP1A2GABRA1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260000642-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS TAY THERAPEUTICS LTD (GB) 2026-01-01 US disclosed
US-20250263370-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2025-08-21 US disclosed
EP-4558224-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2025-05-28 EP disclosed
WO-2024018423-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2024-01-25 WO disclosed
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
CN-105175433-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2015-12-23 CN disclosed
CN-105051027-A Pyridine derivatives as rearranged during transfection (RET) kinase inhibitors GLAXOSMITHKLINE IP DEV LTD 2015-11-11 CN disclosed
CN-102482285-B Novel 2,3-dihydro-1h-imidazo(1,2-a)pyrimidin-5-one derivatives, preparation thereof, and pharmaceutical use thereof SANOFI SA 2015-07-15 CN disclosed
CN-102153562-B Spiro-oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC 2015-05-13 CN disclosed
CN-104066731-A 2-benzyl, 3- (pyrimidin-2-yl) substituted pyrazoles useful as SGC stimulators IRONWOOD PHARMACEUTICALS INC 2014-09-24 CN disclosed
CN-103958508-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC 2014-07-30 CN disclosed
CN-103664973-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2014-03-26 CN disclosed
CN-103097387-A Ring-fused pyrimidines and triazines and use thereof for treating and/or preventing cardiovascular diseases BAYER IP GMBH 2013-05-08 CN disclosed
US-7582644-B2 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
US-20060025432-A1 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ASTRAZENECA AB (SE) 2006-02-02 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 (7 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 3672/4885CES2 1840/4885CES1 1731/4885
US-20200157066-A1 Sulfonamide Compound or Salt Thereof RNASEH1, SNRPA1, RRM2 P2RX7 3672/4885CES2 1840/4885CES1 1731/4885
US-10889555-B2 Sulfonamide compound or salt thereof RNASEH1, SNRPA1, RRM2 P2RX7 3672/4885CES2 1840/4885CES1 1731/4885
US-20260000642-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS BET1, BRD4, PHKB P2RX7 3003/4885CES2 2325/4885CES1 2001/4885
US-20250263370-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS BET1, PHKB, BRD4 P2RX7 3433/4885CES2 4265/4885CES1 3291/4885
US-20060025432-A1 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ACKR3, GPR17, CCL11 P2RX7 577/4885CES2 4876/4885CES1 2635/4885
US-20200405697-A1 Antitumor Agent HNRNPR, RRM2, RRM2B P2RX7 3886/4885CES2 3634/4885CES1 2706/4885

“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.