SCHEMBL242949

SCHEMBL242949

C(C=Nc1ccccc1)=Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.52
KMT2A Q03164 7/20 0.50
ALDH1A1 P00352 4/20 0.50
MAOA P21397 1/20 0.44
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 6/20 0.40
MEN1 O00255 5/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
MIF P14174 1/20 0.39
HTR3E A5X5Y0 1/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
SLC22A3 O75751 1/20 0.39
HTR3B O95264 1/20 0.39

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
SCHEMBL13754812 1.00 S100B (0.52) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL242948 1.00 S100B (0.52) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL5676571 0.97 S100B (0.50) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL4865610 0.97 S100B (0.50) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL22238367 0.89 S100B (0.44) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL23367976 0.83 KMT2A (0.44) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL156585 0.83 KMT2A (0.44) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL7089228 0.83 KMT2A (0.44) S100BKMT2AALDH1A1MAOAKDM4E
SCHEMBL10189846 0.83 KMT2A (0.44) S100BKMT2AALDH1A1MAOAKDM4E
Hydrochloric Acid SCHEMBL10938474 0.81 KMT2A (0.42) S100BKMT2AALDH1A1MAOAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363923-B1 RHODIUM AND IRIDIUM COMPLEXES MERCK PATENT GMBH (DE) 2009-04-01 EP claimed
EP-1562964-B1 PALLADIUM AND PLATINUM COMPLEXES MERCK PATENT GMBH (DE) 2006-07-19 EP claimed
US-20040138455-A1 Rhodium and iridium complexes MERCK PATENT GMBH (DE) 2004-07-15 US claimed
US-12635401-B2 Metal complexes UDC Ireland (IE) 2026-05-19 US disclosed
EP-4174047-B1 METHOD FOR PRODUCING CYCLIC OLEFIN COMPOUND MITSUI CHEMICALS INC (JP) 2026-05-13 EP disclosed
US-20260070936-A1 METAL COMPLEXES UDC IRELAND LTD (IE) 2026-03-12 US disclosed
US-12544733-B2 Gas/liquid oligomerization reactor having successive zones with variable diameters IFP Energies Nouvelles (FR) 2026-02-10 US disclosed
US-12479780-B2 Oligomerisation process comprising a step of recycling a pre-cooled solvent IFP Energies Nouvelles (FR) 2025-11-25 US disclosed
US-12364960-B2 Method for oligomerization in a reactor comprising a gas/liquid double distributor IFP Energies Nouvelles (FR) 2025-07-22 US disclosed
WO-2025119896-A1 METHOD FOR OLIGOMERISING AN OLEFIN FEEDSTOCK IN A TUBULAR LOOP REACTOR IFP Energies Nouvelles (FR) 2025-06-12 WO disclosed
US-12312288-B2 Gas/liquid oligomerization reactor comprising transverse internals IFP Energies Nouvelles (FR) 2025-05-27 US disclosed
EP-0280373-B1 PROCESS FOR THE DIMERIZATION OF OLEFINS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-08-12 EP disclosed
EP-0206367-B1 PROCESS FOR THE DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-27 EP disclosed
US-4859646-A Process for the dimerization of olefins SHELL OIL COMPANY (US) 1989-08-22 US disclosed
US-4806647-A PALLADIUM(II) COMPOUND, CHELATE LIGAND, PROTONIC ACID AND SALT SHELL OIL COMPANY (US) 1989-02-21 US disclosed
EP-0170311-B1 PROCESS FOR THE DIMERIZATION OF OLEFINS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-02-01 EP disclosed
US-4692548-A DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS SHELL OIL COMPANY (US) 1987-09-08 US disclosed
US-4634793-A PALLADIUM CATALYST SYSTEM SHELL OIL COMPANY (US) 1987-01-06 US disclosed
EP-0206367-A2 Process for the dimerization of ethylenically unsaturated compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-12-30 EP disclosed
EP-0170311-A2 Process for the dimerization of olefins SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-02-05 EP 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-12544733-B2 Gas/liquid oligomerization reactor having successive zones with variable diameters NOD1, VAT1, DECR1 S100B 4558/4885KMT2A 4754/4885ALDH1A1 4120/4885
US-20260070936-A1 METAL COMPLEXES SCO2, CBR1, CORO1C S100B 2918/4885KMT2A 3535/4885ALDH1A1 2087/4885
US-12635401-B2 Metal complexes SCO2, SOD1, NR4A1 S100B 3101/4885KMT2A 2648/4885ALDH1A1 2069/4885
US-20040138455-A1 Rhodium and iridium complexes RPIA, MPI, INPP5B S100B 2508/4885KMT2A 4167/4885ALDH1A1 2213/4885
US-12479780-B2 Oligomerisation process comprising a step of recycling a pre-cooled solvent COG4, PRPF40A, PRPF6 S100B 2340/4885KMT2A 4847/4885ALDH1A1 3272/4885
US-12312288-B2 Gas/liquid oligomerization reactor comprising transverse internals DCXR, OTUB1, INF2 S100B 2453/4885KMT2A 4605/4885ALDH1A1 4344/4885
US-12364960-B2 Method for oligomerization in a reactor comprising a gas/liquid double distributor DUOX2, COASY, DUOX1 S100B 3866/4885KMT2A 4776/4885ALDH1A1 4579/4885

“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.