SCHEMBL4557754

SCHEMBL4557754

C=CCOC(=O)NNc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.63
CYP3A4 P08684 2/20 0.50
TSHR P16473 2/20 0.46
ALOX5 P09917 2/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
CASP1 P29466 3/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.45
PTGS2 P35354 1/20 0.44
HSD17B10 Q99714 2/20 0.44
F2 P00734 1/20 0.44
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 1/20 0.41

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
SCHEMBL160077 0.83 NPC1 (0.54) CYP3A4TSHRSMN1; SMN2KDM4EHSD17B10
SCHEMBL11719915 0.78 MEN1 (0.49) GAACYP3A4TSHRSMN1; SMN2CASP1
SCHEMBL15721354 0.78 LMNA (0.50) GAACYP3A4TSHRSMN1; SMN2CASP1
SCHEMBL3463370 0.78 CASP1 (0.52) CYP3A4TSHRSMN1; SMN2CASP1ALDH1A1
SCHEMBL2234441 0.77 GAA (1.00) GAACYP3A4TSHRALOX5SMN1; SMN2
SCHEMBL4908338 0.77 GAA (0.69) GAATSHRSMN1; SMN2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL28240039 0.76 GAA (0.96) GAACYP3A4TSHRALOX5SMN1; SMN2
SCHEMBL11694686 0.75 EPHX1 (0.51) GAACYP3A4SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL11512874 0.75 KAT6A (0.54) GAACYP3A4SMN1; SMN2CASP1ALDH1A1
SCHEMBL10668780 0.74 CYP3A4 (0.47) CYP3A4TSHRSMN1; SMN2CASP1ALDH1A1

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-7592374-B2 Insecticidal nitromethylene compounds CROMPTON CORPORATION (US) 2009-09-22 US disclosed
WO-2006094240-A1 INSECTICIDAL, ACARICIDAL, AND FUNGICIDAL NITOMETHYLENE COMPOUNDS CHEMTURA CORPORATION (US) 2006-09-08 WO disclosed
US-20060199850-A1 Insecticidal, acaricidal, and fungicidal nitromethylene compounds WEBER CITY ROAD LLC 2006-09-07 US disclosed
EP-1226106-A1 PROCESS FOR THE PREPARATION OF INSECTICIDAL PHEYNYLHYDRAZINE DERIVATIVES Crompton Corporation (US) 2002-07-31 EP disclosed
US-6278022-B1 REACTING SUBSTITUTED AROMATIC COMPOUND WITH NITRIC ACID TO FORM NITROAROMATIC COMPOUND; REDUCING NITRO GROUP OF AROMATIC COMPOUND TO FORM CORRESPONDING HYDROCHLORIDE SALT CK WITCO CORPORATION 2001-08-21 US disclosed
WO-2001032599-A1 PROCESS FOR THE PREPARATION OF INSECTICIDAL PHEYNYLHYDRAZINE DERIVATIVES CROMPTON CORPORATION (US) 2001-05-10 WO disclosed
WO-2001032605-A1 PROCESS FOR THE PREPARATION OF INSECTICIDAL PHENYLHYDRAZINE DERIVATIVES CROMPTON CORPORATION (US) 2001-05-10 WO disclosed
US-6166243-A Process for the preparation of insecticidal phenylhydrazine derivatives CK WITCO CORPORATION (US) 2000-12-26 US disclosed
EP-0836596-B1 HYDRAZINE DERIVATIVES UNIROYAL CHEM CO INC (US) 2000-08-23 EP disclosed
EP-0836596-A1 HYDRAZINE DERIVATIVES UNIROYAL CHEMICAL COMPANY, Inc. (US) 1998-04-22 EP disclosed
WO-1997002275-A1 PESTICIDAL PHENYLHYDRAZINE PHOSPHORUS DERIVATIVES UNIROYAL CHEMICAL COMPANY, INC. (US) 1997-01-23 WO disclosed
WO-1997002257-A1 HYDRAZINE DERIVATIVES UNIROYAL CHEMICAL COMPANY, INC. (US) 1997-01-23 WO disclosed
EP-0641316-B1 INSECTICIDAL PHENYLHYDRAZINE DERIVATIVES UNIROYAL CHEM CO INC (US) 1997-01-22 EP disclosed
US-5567723-A Miticidal hydrazine compounds and their intermediates UNIROYAL CHEMICAL COMPANY, INC. (US) 1996-10-22 US disclosed
US-5543404-A MITICIDES UNIROYAL CHEMICAL COMPANY, INC (US) 1996-08-06 US disclosed
US-5536746-A Insecticidal phenylhydrazine derivatives UNIROYAL CHEMICAL COMPANY, INC. (US) 1996-07-16 US disclosed
US-5438123-A Miticides, nematocides UNIROYAL CHEMICAL COMPANY, INC. (US) 1995-08-01 US disclosed
EP-0641316-A1 INSECTICIDAL PHENYLHYDRAZINE DERIVATIVES. UNIROYAL CHEM CO INC (US) 1995-03-08 EP disclosed
US-5367093-A Pesticides UNIROYAL CHEMICAL COMPANY, INC. (US) 1994-11-22 US disclosed
WO-1993010083-A1 INSECTICIDAL PHENYLHYDRAZINE DERIVATIVES UNIROYAL CHEMICAL COMPANY, INC. (US) 1993-05-27 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-20060199850-A1 Insecticidal, acaricidal, and fungicidal nitromethylene compounds NIT2, DDT, AADAC GAA 3908/4885CYP3A4 99/4885TSHR 2547/4885

“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.