SCHEMBL6322759

SCHEMBL6322759

CCOC(=O)CNCc1cccc(N)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPID Q08752 3/20 0.50
PPIB P23284 1/20 0.50
PPIA P62937 1/20 0.50
PPIG Q13427 1/20 0.50
LTA4H P09960 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
MEP1B Q16820 1/20 0.40
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3912954 0.87 MEN1 (0.44) KMT2AALDH1A1HPGDMEP1BMEN1
SCHEMBL6325880 0.86 LTA4H (0.47) PPIDPPIBPPIAPPIGLTA4H
SCHEMBL11954384 0.85 KMT2A (0.53) PPIDPPIBPPIAPPIGLTA4H
SCHEMBL2036271 0.85 PPID (0.71) PPIDPPIBPPIAPPIGSMN1; SMN2
SCHEMBL8168973 0.84 LTA4H (0.50) LTA4HKMT2AALDH1A1MEN1
SCHEMBL23703051 0.83 CYP1A2 (0.50) PPIDLTA4HSMN1; SMN2KMT2AALDH1A1
SCHEMBL3168451 0.83 HDAC1 (0.50) PPIDLTA4HSMN1; SMN2KMT2AALDH1A1
SCHEMBL5182549 0.83 PPID (0.49) PPIDPPIBPPIAPPIGLTA4H
SCHEMBL21391612 0.82 PPID (0.71) PPIDPPIBPPIAPPIGLTA4H
SCHEMBL10011061 0.82 MEN1 (0.60) SMN1; SMN2KMT2AALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868617-B Liquid crystal aligning agent, polymer for obtaining the same, liquid crystal alignment film, and liquid crystal display element using the same 日产化学株式会社 2023-09-12 CN disclosed
CN-111868617-A Liquid crystal aligning agent, polymer for obtaining the same, liquid crystal alignment film, and liquid crystal display element using the same 日产化学株式会社 2020-10-30 CN disclosed
WO-2019182070-A1 LIQUID CRYSTAL ALIGNING AGENT, POLYMER FOR OBTAINING SAME, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME 日産化学株式会社 2019-09-26 WO disclosed
US-6855710-B2 Substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-02-15 US disclosed
US-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-25 US disclosed
EP-1115704-B1 NOVEL SUBSTITUTED INDOLINONES WITH AN INHIBITORY EFFECT ON VARIOUS KINASES AND CYCLIN/CDK COMPLEXES BOEHRINGER INGELHEIM PHARMA (DE) 2003-06-18 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 (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-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs CDK1, CDK2, CDK3 PPID 3161/4885PPIB 3253/4885PPIA 2897/4885

“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.