SCHEMBL4488889

SCHEMBL4488889

NC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
KIF11 P52732 4/20 0.59
GPR35 Q9HC97 1/20 0.58
P2RX1 P51575 5/20 0.56
LMNA P02545 1/20 0.56
ACP1 P24666 1/20 0.54
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
JUN P05412 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
P2RX4 Q99571 1/20 0.51
P2RX7 Q99572 1/20 0.51
TACR1 P25103 1/20 0.51
IKBKE Q14164 2/20 0.51
IKBKB O14920 1/20 0.50

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
SCHEMBL16379971 0.91 MAPT (0.57) MAPTKIF11GPR35P2RX1LMNA
SCHEMBL3482455 0.89 KIF11 (0.53) MAPTKIF11GPR35P2RX1LMNA
SCHEMBL31356653 0.87 MAPT (0.57) MAPTKIF11GPR35P2RX1LMNA
SCHEMBL5448110 0.87 ACP1 (0.60) MAPTKIF11GPR35P2RX1LMNA
SCHEMBL7692960 0.83 GPR35 (0.74) MAPTGPR35P2RX1LMNAACP1
SCHEMBL2681462 0.83 MAPT (0.78) MAPTGPR35P2RX1LMNAACP1
SCHEMBL4099566 0.82 MAPT (0.51) MAPTGPR35P2RX1LMNAACP1
SCHEMBL167618 0.81 KIF11 (0.79) MAPTKIF11P2RX1LMNACA12
SCHEMBL11788448 0.81 MAPT (0.63) MAPTGPR35P2RX1LMNAACP1
SCHEMBL5833345 0.81 GPR35 (0.66) MAPTGPR35P2RX1LMNAACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116200157-A Preparation method of bio-based degradable polyester pressure-sensitive adhesive 青岛科技大学 2023-06-02 CN claimed
US-20060281725-A1 Agents and crystals for improving excretory potency of urinary bladder ISIHARA YUJI 2006-12-14 US claimed
EP-1604653-A1 Acetylcholinesterase inhibitors for improving excretory potency of urinary bladder Takeda Pharmaceutical Company Limited (JP) 2005-12-14 EP claimed
US-20040116457-A1 Agents for improving excretory potency of urinary bladder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-06-17 US claimed
US-20020177593-A1 Agents and crystals for improving excretory potency of urinary bladder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-11-28 US claimed
EP-1118322-A1 DRUGS FOR IMPROVING VESICAL EXCRETORY STRENGTH Takeda Chemical Industries, Ltd. (JP) 2001-07-25 EP claimed
EP-1005459-A1 SUBSTITUTED ISOQUINOLINES AS ANTICONVULSIVANTS SMITHKLINE BEECHAM PLC (GB) 2000-06-07 EP claimed
WO-1999014197-A1 SUBSTITUTED ISOQUINOLINES AS ANTICONVULSIVANTS SMITHKLINE BEECHAM PLC (GB) 1999-03-25 WO claimed
CN-116875013-B Fully degradable toughened polylactic acid material and preparation method thereof 青岛科技大学 2025-05-16 CN disclosed
CN-119684577-A Novel bio-based thermoplastic elastomer capable of being recycled in closed loop and preparation method thereof 青岛科技大学 2025-03-25 CN disclosed
CN-115725058-B Preparation method of degradable and recyclable copolyester and application of degradable and recyclable copolyester in pressure-sensitive adhesive 东莞市成铭胶粘剂有限公司 2024-01-05 CN disclosed
CN-116875013-A Fully degradable toughened polylactic acid material and preparation method thereof 青岛科技大学 2023-10-13 CN disclosed
CN-114479023-B Novel bio-based degradable thermoplastic elastomer and preparation method thereof 青岛科技大学 2023-09-29 CN disclosed
CN-111704714-B Benzo five-membered and six-membered cyclic (thio) urea catalyst and application thereof in ring-opening polymerization 浙江大学 2023-08-04 CN disclosed
US-6534496-B1 Prophylactic and/or therapeutic drug for obesity and obesity associated diseasestor diabetes with a reduced risk for central side effects and high universality in usage. Another object of the a lipolytic agent, or a prophylactic and/or TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 2003-03-18 US disclosed
US-20020177593-A1 Agents and crystals for improving excretory potency of urinary bladder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-11-28 US disclosed
EP-1122252-A1 NITROGENOUS FUSED HETEROCYCLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME Takeda Chemical Industries, Ltd. (JP) 2001-08-08 EP disclosed
EP-1118322-A1 DRUGS FOR IMPROVING VESICAL EXCRETORY STRENGTH Takeda Chemical Industries, Ltd. (JP) 2001-07-25 EP disclosed
EP-0975624-A1 THERMOGENIC COMPOSITION AND BENZAZEPINE THERMOGENICS Takeda Chemical Industries, Ltd. (JP) 2000-02-02 EP disclosed
WO-1998046590-A1 THERMOGENIC COMPOSITION AND BENZAZEPINE THERMOGENICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-22 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 (2 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-20020177593-A1 Agents and crystals for improving excretory potency of urinary bladder ACHE, BPHL, BCHE MAPT 1206/4885KIF11 1769/4885GPR35 3592/4885
US-20060281725-A1 Agents and crystals for improving excretory potency of urinary bladder ACHE, BCHE, PDE7A MAPT 1290/4885KIF11 1878/4885GPR35 3231/4885

“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.