SCHEMBL671986

SCHEMBL671986

O=C(Nc1ccccc1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.78
MEN1 O00255 2/20 0.78
HTT P42858 2/20 0.78
RAB9A P51151 2/20 0.78
KMT2A Q03164 2/20 0.78
P2RX1 P51575 2/20 0.68
CA12 O43570 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
TACR1 P25103 2/20 0.62
EPHX2 P34913 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
TP53 P04637 1/20 0.61
EPHX1 P07099 1/20 0.61
TSHR P16473 1/20 0.61
CDK9 P50750 1/20 0.61
CLK4 Q9HAZ1 1/20 0.61
KDR P35968 2/20 0.60
NPC1 O15118 1/20 0.59

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
Tetramethylammonium Ion SCHEMBL28296040 0.94 MAPT (0.69) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL11001524 0.90 KDR (0.73) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL2681462 0.89 MAPT (0.78) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL17609423 0.88 MAPT (1.00) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL30069239 0.88 MAPT (1.00) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL11001590 0.87 EPHX2 (0.81) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL16628034 0.86 MAPT (0.60) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL4548071 0.85 EPHX2 (0.85) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL17664317 0.84 KMT2A (0.81) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL16628060 0.84 CA12 (0.66) MAPTMEN1HTTRAB9AKMT2A

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12540212-B2 Synthesis of polyurethane polymers in flow reactors INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2026-02-03 US claimed
US-20220380516-A1 SYNTHESIS OF POLYURETHANE POLYMERS IN FLOW REACTORS INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-12-01 US claimed
WO-2022237492-A1 SYNTHESIS OF POLYURETHANE POLYMERS IN FLOW REACTORS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-11-17 WO claimed
US-10815335-B2 Ring-opening polymerizations using a flow reactor INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2020-10-27 US claimed
US-12540212-B2 Synthesis of polyurethane polymers in flow reactors INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2026-02-03 US 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-118184973-A Multifunctional CO2Base copolyester and preparation method thereof 青岛科技大学 2024-06-14 CN disclosed
US-20220380516-A1 SYNTHESIS OF POLYURETHANE POLYMERS IN FLOW REACTORS INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-12-01 US disclosed
WO-2022237492-A1 SYNTHESIS OF POLYURETHANE POLYMERS IN FLOW REACTORS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-11-17 WO disclosed
US-11286341-B2 Ring-opening polymerizations using a flow reactor INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-03-29 US disclosed
CN-109776782-B Ionic organic catalyst and preparation method and application thereof 华南理工大学 2021-02-19 CN disclosed
US-20200407496-A1 RING-OPENING POLYMERIZATIONS USING A FLOW REACTOR INTERNATIONAL BUSINESS MACHINES CORPORATION 2020-12-31 US disclosed
US-10815335-B2 Ring-opening polymerizations using a flow reactor INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2020-10-27 US disclosed
CN-109776782-A A kind of ionic organic catalyst and its preparation method and application 华南理工大学 2019-05-21 CN disclosed
EP-2590938-A1 NOVEL SULFONAMIDE COMPOUNDS FOR INHIBITION OF METASTATIC TUMOR GROWTH Metasignal Therapeutics Inc. (CA) 2013-05-15 EP disclosed
WO-2012021963-A1 NOVEL SULFONAMIDE COMPOUNDS FOR INHIBITION OF METASTATIC TUMOR GROWTH METASIGNAL THERAPEUTICS INC. (CA) 2012-02-23 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 (1 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-12540212-B2 Synthesis of polyurethane polymers in flow reactors PUF60, DUS2, ALKBH3 MAPT 1520/4885MEN1 4336/4885HTT 3472/4885

“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.