SCHEMBL211770

SCHEMBL211770

C[C@@H](N=C=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.63
NOS2 P35228 1/20 0.44
ADRA2C P18825 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
ADRA2A P08913 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HSD11B1 P28845 4/20 0.38
CHRM2 P08172 1/20 0.38
ADRA1A P35348 1/20 0.38
RGS12 O14924 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
PKM P14618 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL7980 1.00 MIF (0.63) MIFNOS2ADRA2CKDM4ELMNA
SCHEMBL6583 1.00 MIF (0.63) MIFNOS2ADRA2CKDM4ELMNA
SCHEMBL27902285 0.94 MIF (0.57) MIFNOS2ADRA2CKDM4ELMNA
SCHEMBL23070416 0.94 MIF (0.57) MIFNOS2ADRA2CKDM4ELMNA
SCHEMBL443529 0.88 MIF (0.46) MIFNOS2CYP3A4
SCHEMBL28671467 0.88 MIF (0.50) MIFCYP2C9PKMCYP2C19
SCHEMBL22279429 0.88 MIF (0.50) MIFCYP2C9PKMCYP2C19
SCHEMBL7192060 0.84 MIF (0.45) MIFNOS2KDM4ELMNAHIF1A
SCHEMBL22265179 0.83 MIF (0.46) MIFADRA2CLMNAADRA2AALDH1A1
SCHEMBL22265178 0.83 MIF (0.46) MIFADRA2CLMNAADRA2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025131930-A1 NON-AQUEOUS COATING COMPOSITION ALLNEX NETHERLANDS B.V. (NL) 2025-06-26 WO claimed
US-11760750-B1 Process for preparing levoketoconazole NURAY CHEMICALS PRIVATE LIMITED (IN) 2023-09-19 US claimed
US-20220380303-A1 PROCESS FOR THE DISTILLATION OF ISOCYANATES COVESTRO DEUTSCHLAND AG (DE) 2022-12-01 US claimed
CN-113720925-A Separation detection method of isocyanate derivative 武汉武药科技有限公司 2021-11-30 CN claimed
CN-109725073-B Separation and detection method of acetylcysteine enantiomer 湖南华纳大药厂科技开发有限公司 2021-10-15 CN claimed
CN-111978448-B Ureido-modified (S) -2-ethynylpyrrolidine and preparation method and application thereof 北京大学 2021-04-13 CN claimed
CN-111978448-A Ureido-modified (S) -2-ethynylpyrrolidine and preparation method and application thereof 北京大学 2020-11-24 CN claimed
EP-1717223-B1 Method for the purification of isocyanates BASF SE (DE) 2016-07-20 EP claimed
US-8088944-B2 Method for the purification of isocyanates BASF SE (DE) 2012-01-03 US claimed
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US claimed
WO-2009056993-A2 A PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-05-07 WO claimed
EP-1487448-A4 TREATMENT OF EFFECT OF CHEMICALS WITH THEIR ULTRADILUTE STEREOISOMERS SEMPACH PTY LTD (AU) 2007-04-25 EP claimed
US-20070015934-A1 Method for the purification of isocyanates BASF AKTIENGESELLSCHAFT (DE) 2007-01-18 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20050119350-A1 Treatment of effect of chemicals with their ultradilute stereoisomers SEMPACH PTY LTD ACN 078 746 522 (AU) 2005-06-02 US claimed
EP-1487448-A1 TREATMENT OF EFFECT OF CHEMICALS WITH THEIR ULTRADILUTE STEREOISOMERS Sempach PTY Ltd (AU) 2004-12-22 EP claimed
WO-2003072105-A1 TREATMENT OF EFFECT OF CHEMICALS WITH THEIR ULTRADILUTE STEREOISOMERS SEMPACH PTY LTD (AU) 2003-09-04 WO claimed
EP-4739393-A1 TETRAHYDROQUINAZOLINE DERIVATIVES AS SELECTIVE CYTOTOXIC AGENTS Merck Sharp & Dohme LLC (US) 2026-05-13 EP disclosed
EP-0179619-A1 Heterocyclic amides ICI AMERICAS INC. (US) 1986-04-30 EP disclosed
EP-0077983-A1 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-05-04 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 (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-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 MIF 3168/4885NOS2 1398/4885ADRA2C 854/4885
US-11760750-B1 Process for preparing levoketoconazole KHK, KYAT3, PLK3 MIF 2851/4885NOS2 3874/4885ADRA2C 1571/4885

“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.