SCHEMBL3841008

SCHEMBL3841008

CC(C)c1ccc(Cl)cc1CN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
TP53 P04637 1/20 0.47
CYP2A6 P11509 1/20 0.41
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
PNMT P11086 3/20 0.36
MEN1 O00255 1/20 0.36
SLC22A1 O15245 1/20 0.36
USP2 O75604 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
HSPD1 P10809 1/20 0.36
HSPA5 P11021 1/20 0.36
IDO1 P14902 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL3843302 0.85 LMNA (0.44) LMNAHTTTP53GABRA1GABRB1
SCHEMBL3842902 0.84 HTT (0.42) LMNAHTTTP53CYP2A6GABRA1
SCHEMBL13908891 0.82 LMNA (0.44) LMNAHTTTP53GABRA1GABRB1
SCHEMBL14485295 0.80 LMNA (0.42) LMNAHTTTP53GABRA1GABRB1
SCHEMBL10053114 0.80 LMNA (0.42) LMNAHTTTP53GABRA1GABRB1
SCHEMBL14572026 0.78 LMNA (0.41) LMNAHTTTP53GABRA1GABRB1
SCHEMBL26137536 0.78 HTR1D (0.40) LMNAHTTGABRA1IDO1ALOX12
SCHEMBL3849204 0.78 SLC6A2 (0.50) LMNACYP2A6SLC6A2SLC6A3
SCHEMBL7486888 0.77 HTT (0.40) LMNAHTTTP53GABRA1GABRB1
SCHEMBL28135905 0.77 SIRT1 (0.49) LMNAHTTTP53HSP90AA1LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190092765-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-03-28 US disclosed
EP-2838893-B1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-03-13 EP disclosed
US-10125126-B2 N-cycloalkyl-N-[(heterocyclylphenyl)methylene]-(thio)carboxamide derivatives BAYER CROPSCIENCE AG (DE) 2018-11-13 US disclosed
CN-104428294-B N cycloalkyl N [(heterocyclyl phenyl) methylene] (thio) carboxamide derivative 拜尔农科股份公司 2017-07-14 CN disclosed
US-20170158702-A1 MULTIVALENT RAS BINDING COMPOUNDS KYRAS THERAPEUTICS, INC. 2017-06-08 US disclosed
US-20170158702-A1 MULTIVALENT RAS BINDING COMPOUNDS KYRAS THERAPEUTICS, INC. 2017-06-08 US disclosed
US-20150210678-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2015-07-30 US disclosed
CN-104428294-A N-cycloalkyl-n-[(heterocyclylphenyl)methylene]-(thio)carboxamide derivatives BAYER CROPSCIENCE AG 2015-03-18 CN disclosed
EP-2838893-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES Bayer Cropscience AG (DE) 2015-02-25 EP disclosed
WO-2013156559-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2013-10-24 WO disclosed
US-6916806-B2 Medicinal composition containing 1,3-thiazine derivative SHIONOGI & CO., LTD. (JP) 2005-07-12 US disclosed
US-20050124617-A1 2-Imino-1,3-thiazine derivatives HANASAKI KOJI (JP) 2005-06-09 US disclosed
US-20050101590-A1 Cannabinoid receptor agonists SHIONOGI & CO., LTD. (JP) 2005-05-12 US disclosed
EP-1477186-A1 ANTIPRURITICS SHIONOGI & CO., LTD. (JP) 2004-11-17 EP disclosed
US-6818640-B1 BIND SELECTIVELY TO CANNABINOID 2 RECEPTOR; ANTIINFLAMMATORY AGENTS SHIONOGI & CO., LTD. (JP) 2004-11-16 US disclosed
CN-1514831-A Medicinal composition containing 1,3-thiazine derivative ��Ұ����ҩ��ʽ���� 2004-07-21 CN disclosed
US-20040116326-A1 Medicinal composition containing 1,3-thiazine derivative SHIONOGI & CO., LTD. (JP) 2004-06-17 US disclosed
EP-1375489-A1 MEDICINAL COMPOSITION CONTAINING 1,3-THIAZINE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2004-01-02 EP disclosed
CN-1387519-A 2-imino-1, 3-thiazine derivatives SHIONOGI & CO (JP) 2002-12-25 CN disclosed
EP-1219612-A1 2-IMINO-1,3-THIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2002-07-03 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 (6 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-20050101590-A1 Cannabinoid receptor agonists CNR1, CNR2, OPRL1 LMNA 4521/4885HTT 3822/4885TP53 4877/4885
US-20150210678-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES CBR3, NANP, CBR1 LMNA 2609/4885HTT 518/4885TP53 4449/4885
US-20170158702-A1 MULTIVALENT RAS BINDING COMPOUNDS KRAS, HRAS, NRAS LMNA 2826/4885HTT 2790/4885TP53 10/4885
US-10125126-B2 N-cycloalkyl-N-[(heterocyclylphenyl)methylene]-(thio)carboxamide derivatives CBR3, NANP, CBR1 LMNA 2609/4885HTT 518/4885TP53 4449/4885
US-20050124617-A1 2-Imino-1,3-thiazine derivatives CNR2, CNR1, HTR2C LMNA 3850/4885HTT 2541/4885TP53 4771/4885
US-20190092765-A1 N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES CBR3, CBR1, NANP LMNA 2520/4885HTT 559/4885TP53 4412/4885

“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.