SCHEMBL4893046

SCHEMBL4893046

FC(F)(F)c1ccc(-c2cc3ccccc3[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.65
RAB9A P51151 3/20 0.65
MAPT P10636 3/20 0.62
KDM4E B2RXH2 2/20 0.62
CASP3 P42574 2/20 0.62
SENP8 Q96LD8 2/20 0.62
SENP7 Q9BQF6 2/20 0.62
SENP6 Q9GZR1 2/20 0.62
ALDH1A1 P00352 2/20 0.62
MEN1 O00255 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C9 P11712 1/20 0.62
HPGD P15428 1/20 0.62
CYP2C19 P33261 1/20 0.62
KMT2A Q03164 1/20 0.62
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
APP P05067 2/20 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
SCHEMBL30047184 1.00 NPC1 (0.65) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL5053299 0.85 NPC1 (0.87) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL28416625 0.83 NPC1 (0.83) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL6957778 0.83 RAB9A (0.65) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL4884700 0.81 NPC1 (0.58) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL15058606 0.81 CYP19A1 (0.58) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL20508334 0.81 KDM4E (0.51) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL2061664 0.80 RAB9A (0.71) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL29496847 0.80 RAB9A (0.71) NPC1RAB9AMAPTKDM4ECASP3
SCHEMBL10997076 0.80 NPC1 (0.92) NPC1RAB9AMAPTKDM4ECASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221563-A Synthesis method of 2-aryl indole 南京工业大学 2024-06-21 CN disclosed
CN-115304533-B Bisindolemethane type alpha-glucosidase inhibitor and preparation method and application thereof 中国医学科学院药用植物研究所云南分所 2024-04-12 CN disclosed
CN-115304533-A Bis-indole methane type alpha-glucosidase inhibitor and preparation method and application thereof 中国医学科学院药用植物研究所云南分所 2022-11-08 CN disclosed
CN-111087391-A 4-indole quinazoline compound and preparation method and application thereof 郑州大学 2020-05-01 CN disclosed
CN-105636951-B Amide derivatives and its officinal salt, its preparation method and its application in medicine 上海恒瑞医药有限公司 2018-05-15 CN disclosed
US-20080039625-A1 Screening Methods LAUTENS MARK 2008-02-14 US disclosed
US-20080039625-A1 Screening Methods LAUTENS MARK 2008-02-14 US disclosed
US-20080039625-A1 Screening Methods LAUTENS MARK 2008-02-14 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 (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-20080039625-A1 Screening Methods CBR3, ZKSCAN2, CRBN NPC1 1583/4885RAB9A 444/4885MAPT 4661/4885

“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.