SCHEMBL30069239

SCHEMBL30069239

O=C(Nc1ccccc1)Nc1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 1.00
KMT2A Q03164 4/20 1.00
MEN1 O00255 2/20 1.00
HTT P42858 2/20 1.00
RAB9A P51151 1/20 1.00
GRIK1 P39086 4/20 0.74
ALDH1A1 P00352 1/20 0.73
KDR P35968 2/20 0.71
LMNA P02545 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
NPSR1 Q6W5P4 1/20 0.68
KDM4E B2RXH2 1/20 0.67
CA12 O43570 1/20 0.67
CA1 P00915 1/20 0.67
CA2 P00918 1/20 0.67
CA9 Q16790 1/20 0.67
TP53 P04637 1/20 0.67
GAA P10253 1/20 0.67
BAZ1A Q9NRL2 1/20 0.65
MTOR P42345 1/20 0.65

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
SCHEMBL17609423 1.00 MAPT (1.00) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL30101230 0.95 KMT2A (0.90) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL5597699 0.95 KMT2A (0.90) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL10217915 0.94 KMT2A (0.88) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL4548162 0.93 KMT2A (0.87) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL17664319 0.90 KMT2A (0.82) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL19403890 0.90 MAPT (0.81) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL17664317 0.90 KMT2A (0.81) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL6430883 0.89 KMT2A (0.80) MAPTKMT2AMEN1HTTRAB9A
SCHEMBL29494989 0.89 MAPT (0.79) MAPTKMT2AMEN1HTTRAB9A

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 6 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-12540212-B2 Synthesis of polyurethane polymers in flow reactors INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2026-02-03 US 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

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 1520/4885KMT2A 3341/4885MEN1 4336/4885

“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.