SCHEMBL7108904

SCHEMBL7108904

C(=C/c1ccccc1)\CCOCC/C=C/c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.52
SIGMAR1 Q99720 2/20 0.47
PAM P19021 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOB P27338 1/20 0.44
HTR2A P28223 3/20 0.44
NAAA Q02083 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL7108908 1.00 IDO1 (0.52) IDO1SIGMAR1PAMMEN1KMT2A
SCHEMBL28661525 0.89 HRH3 (0.49) IDO1SIGMAR1PAMMEN1KMT2A
SCHEMBL10889742 0.87 IDO1 (0.48) IDO1SIGMAR1PAMMEN1KMT2A
SCHEMBL7110889 0.87 IDO1 (0.48) IDO1SIGMAR1PAMMEN1KMT2A
SCHEMBL4372992 0.85 MAOB (0.56) IDO1PAMMEN1KMT2AMAOB
SCHEMBL9762776 0.83 IDO1 (0.42) IDO1SIGMAR1PAMMEN1KMT2A
SCHEMBL7939387 0.83 IDO1 (0.56) IDO1SIGMAR1PAMMAOBHTR2A
SCHEMBL10430031 0.83 IDO1 (0.56) IDO1SIGMAR1PAMMAOBHTR2A
SCHEMBL7568412 0.83 IDO1 (0.56) IDO1SIGMAR1PAMMAOBHTR2A
SCHEMBL15907605 0.83 MEN1 (0.61) IDO1SIGMAR1PAMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691958-B2 Enantioselective cross dehydrogenative coupling reactions and compounds synthesized by the reactions NORTHWESTERN UNIVERSITY (US) 2023-07-04 US disclosed
US-20220259171-A1 ENANTIOSELECTIVE CROSS DEHYDROGENATIVE COUPLING REACTIONS AND COMPOUNDS SYNTHESIZED BY THE REACTIONS NORTHWESTERN UNIVERSITY (US) 2022-08-18 US disclosed
US-11174238-B2 Enantioselective cross dehydrogenative coupling reactions and compounds synthesized by the reactions NORTHWESTERN UNIVERSITY (US) 2021-11-16 US disclosed
US-20200181106-A1 ENANTIOSELECTIVE CROSS DEHYDROGENATIVE COUPLING REACTIONS AND COMPOUNDS SYNTHESIZED BY THE REACTIONS NORTHWESTERN UNIVERSITY (US) 2020-06-11 US disclosed
EP-0794218-B1 Polycarbonate resin composition stabilized against radiation MITSUBISHI ENG PLASTICS CORP (JP) 2003-10-15 EP disclosed
US-6040367-A EXCELLENT RESISTANCE TO AN IONIZING RADIATION, IN WHICH HETEROCYCLIC COMPOUND CONTAINING OXYMETHYLENE UNITS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2000-03-21 US disclosed
US-5948838-A 0.01 TO 5 PARTS BY WEIGHT OF A COMPOUND CONTAINING OXYMETHYLENE UNIT MITSUBISHI ENGINEERING-PLASTICS CORP. (JP) 1999-09-07 US disclosed
EP-0794218-A2 Polycarbonate resin composition stabilized against radiation MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 1997-09-10 EP disclosed
US-5508412-A USED IN FORMATION OF UNSATURATED CYCLOHEXENONE OXIME ETHERS; HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-04-16 US disclosed
US-5407896-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1995-04-18 US disclosed
US-5403812-A Also containing a sulfur-containing ring; control of grasses but selective of broad-leaved and monocotyledonous crops BASF AKTIENGESELLSCHAFT (DE) 1995-04-04 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 (4 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-11691958-B2 Enantioselective cross dehydrogenative coupling reactions and compounds synthesized by the reactions DUOX1, DUOX2, ALDH3A1 IDO1 763/4885SIGMAR1 3505/4885PAM 1237/4885
US-20220259171-A1 ENANTIOSELECTIVE CROSS DEHYDROGENATIVE COUPLING REACTIONS AND COMPOUNDS SYNTHESIZED BY THE REACTIONS DUOX1, DUOX2, ALDH3A1 IDO1 763/4885SIGMAR1 3505/4885PAM 1237/4885
US-20200181106-A1 ENANTIOSELECTIVE CROSS DEHYDROGENATIVE COUPLING REACTIONS AND COMPOUNDS SYNTHESIZED BY THE REACTIONS DUOX1, DUOX2, ALDH3A1 IDO1 763/4885SIGMAR1 3505/4885PAM 1237/4885
US-11174238-B2 Enantioselective cross dehydrogenative coupling reactions and compounds synthesized by the reactions DUOX1, DUOX2, ALDH3A1 IDO1 763/4885SIGMAR1 3505/4885PAM 1237/4885

“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.