SCHEMBL707907

SCHEMBL707907

c1ccc2nc(-c3ccsc3)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 13/20 0.59
NPC1 O15118 13/20 0.59
AR P10275 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 9/20 0.51
SMN1; SMN2 Q16637 8/20 0.51
ALDH1A1 P00352 7/20 0.51
MAPT P10636 5/20 0.51
HSD17B10 Q99714 4/20 0.51
TP53 P04637 3/20 0.51
PKM P14618 3/20 0.51
HPGD P15428 3/20 0.51
GMNN O75496 1/20 0.51
THPO P40225 1/20 0.51

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
SCHEMBL30125150 1.00 RAB9A (0.59) RAB9ANPC1ARCYP3A4CYP1A2
SCHEMBL28162213 0.86 PTGS2 (0.51) RAB9ANPC1ARCYP3A4CYP1A2
2-Phenylquinoline SCHEMBL18143576 0.78 RAB9A (0.59) RAB9ANPC1ARCYP3A4CYP1A2
SCHEMBL12112870 0.78 RAB9A (0.80) RAB9ANPC1ARCYP3A4CYP1A2
SCHEMBL707757 0.76 PDGFRB (0.58) RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL28184297 0.76 BACE1 (0.49) RAB9ANPC1KMT2AMAPTPDGFRB
2-Phenylquinoline SCHEMBL44999 0.76 RAB9A (0.73) RAB9ANPC1ARCYP3A4CYP1A2
2-Phenylquinoline SCHEMBL29399739 0.76 RAB9A (0.73) RAB9ANPC1ARCYP3A4CYP1A2
SCHEMBL170196 0.75 RAB9A (0.64) RAB9ANPC1ARCYP3A4CYP1A2
SCHEMBL29374931 0.75 RAB9A (0.64) RAB9ANPC1ARCYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115448876-B Asymmetric transfer hydrogenation method for quinoline 哈尔滨工业大学(深圳) 2023-10-31 CN disclosed
CN-115448876-A Asymmetric transfer hydrogenation method for quinoline 哈尔滨工业大学(深圳) 2022-12-09 CN disclosed
CN-109071446-B Organic reaction in aqueous solution in the presence of hydroxyalkyl (alkyl) cellulose or alkylcellulose 艾伯维德国有限责任两合公司 2022-06-21 CN disclosed
CN-113121427-B Quinoline derivative and preparation method and application thereof 广东工业大学 2022-04-01 CN disclosed
CN-113929623-A Synthesis method of 2-arylquinoline compound 温州医科大学附属口腔医院 2022-01-14 CN disclosed
CN-113121427-A Quinoline derivative and preparation method and application thereof 广东工业大学 2021-07-16 CN disclosed
CN-110467568-A A kind of synthetic method of aryl quinoline derivatives UNIV WENZHOU 2019-11-19 CN disclosed
WO-2015040424-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AND THEIR USE AS PYRUVATE DEHYDROGENASE KINASE INHIBITORS VERNALIS (R&D) LIMITED (GB) 2015-03-26 WO disclosed
US-8124625-B2 enhancing the expression of apoAI; prevention or therapy of dislipidemia SHIONOGI & CO., LTD. (JP) 2012-02-28 US disclosed
US-8053445-B2 Utilities of olefin derivatives SHIONOGI & CO., LTD. (JP) 2011-11-08 US disclosed
US-20090036457-A1 Utilities of olefin derivatives YAMAMORI TERUO 2009-02-05 US disclosed
US-20040242615-A1 Utilities of olefin derivatives SHIONOGI & CO., LTD. (JP) 2004-12-02 US 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-20040242615-A1 Utilities of olefin derivatives APOL1, NR1H2, APOB RAB9A 4723/4885NPC1 19/4885AR 49/4885
US-20090036457-A1 Utilities of olefin derivatives APOL1, APOB, NR1H2 RAB9A 4606/4885NPC1 48/4885AR 203/4885

“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.