SCHEMBL5889291

SCHEMBL5889291

O=C1CCC(c2ccccc2O)N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.42
DDB1 Q16531 3/20 0.42
CRBN Q96SW2 3/20 0.42
RAB9A P51151 2/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PARP1 P09874 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
PIN1 Q13526 1/20 0.37
HDAC2 Q92769 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
APP P05067 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL16344586 0.88 MEN1 (0.42) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL620338 0.83 AR (0.42) RAB9AGAAMEN1KMT2AALDH1A1
SCHEMBL22201148 0.79 DDB1 (0.57) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL31444352 0.79 GAA (0.56) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL19745457 0.79 GAA (0.56) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL24282772 0.79 TNKS2 (0.42) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL16796822 0.79 DDB1 (0.57) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL16096236 0.78 IKBKB (0.40) IKBKBDDB1CRBNRAB9AGAA
SCHEMBL25742792 0.77 PIN1 (0.38) IKBKBDDB1CRBNMEN1KMT2A
SCHEMBL16796841 0.75 HTR2C (0.49) IKBKBDDB1CRBNGAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122506-B2 Cyclic imines as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2006-10-17 US disclosed
CN-1198800-C 2- (2-chlorophenyl) -3, 4-dihydro-2H-pyrrole derivatives BAYER AG (DE) 2005-04-27 CN disclosed
EP-1077938-B1 2-(2-METHYLPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2005-04-13 EP disclosed
US-20040186287-A1 Cyclic imines as pesticides PLANT ANDREW (DE) 2004-09-23 US disclosed
EP-1080072-B1 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2004-08-04 EP disclosed
US-6770595-B2 ACTIVITY AGAINST ARTHROPODS IN AGRICULTURE AND PARASITES ENCOUNTERED IN ANIMAL HUSBANDRY BAYER AKTIENGESELLSCHAFT (DE) 2004-08-03 US disclosed
US-6599924-B1 2-hetaryl-3,4 dihydro-2H-pyrrole pesticide BAYER AKTIENGESELLSCHAFT (DE) 2003-07-29 US disclosed
EP-1306371-A1 Cyclic imines Bayer CropScience AG (DE) 2003-05-02 EP disclosed
EP-0942901-B1 CYCLIC IMINES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-03-05 EP disclosed
US-6489490-B1 PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-12-03 US disclosed
US-20020151571-A1 Cyclic imines as pesticides PLANT ANDREW (DE) 2002-10-17 US disclosed
US-6399771-B1 AGRICULTURE; VETERINARY MEDICINE BAYER AKTIENGESELLSCHAFT (DE) 2002-06-04 US disclosed
CN-1309636-A 2-(2-chlorophenyl)-3,4-dihydro-2H-pyrrol derivs. BAYER AG (DE) 2001-08-22 CN disclosed
US-6274613-B1 APPLYING COMPOUNDS SUCH AS A GAMMA-ETHOXY-GAMMA-BUTYROLACTAM TO PESTS AND/OR THEIR HABITATS BAYER AKTIENGESELLSCHAFT (DE) 2001-08-14 US disclosed
EP-1121357-A1 2-HETARYL-3,4-DIHYDRO-2H-PYRROLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2001-08-08 EP disclosed
EP-1080072-A1 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES Bayer Aktiengesellschaft (DE) 2001-03-07 EP disclosed
WO-2000021958-A1 2-HETARYL-3,4-DIHYDRO-2H-PYRROLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-20 WO disclosed
WO-1999059968-A1 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1999-11-25 WO disclosed
EP-0942901-A1 CYCLIC IMINES AS PESTICIDES BAYER AG (DE) 1999-09-22 EP disclosed
WO-1998022438-A1 CYCLIC IMINES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-05-28 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-20020151571-A1 Cyclic imines as pesticides DDT, CYP1A1, AR IKBKB 4031/4885DDB1 788/4885CRBN 711/4885
US-20040186287-A1 Cyclic imines as pesticides DDT, CYP1A1, AR IKBKB 4095/4885DDB1 789/4885CRBN 615/4885

“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.