SCHEMBL5905720

SCHEMBL5905720

O=Cc1cccc(OCc2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TRPV3 Q8NET8 1/20 0.42
PKM P14618 1/20 0.42
GRM5 P41594 1/20 0.42
CCNB2 O95067 2/20 0.41
CDK1 P06493 2/20 0.41
CDK4 P11802 2/20 0.41
CCNB1 P14635 2/20 0.41
CCND1 P24385 2/20 0.41
CCNB3 Q8WWL7 2/20 0.41
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NUDT1 P36639 1/20 0.39
ALKBH1 Q13686 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
SCHEMBL2524154 0.84 L3MBTL1 (0.52) MAOAMAOBMAPTL3MBTL1RAB9A
SCHEMBL13754873 0.83 GRM5 (0.41) MAOBL3MBTL1TRPV3PKMGRM5
SCHEMBL29056065 0.81 TERT (0.44) NPC1GRM5
SCHEMBL9756829 0.80 KDM4E (0.53) PKM
SCHEMBL9756831 0.80 KDM4E (0.53) PKM
SCHEMBL12523548 0.78 MAOB (0.41) MAOAMAOBMAPTL3MBTL1RAB9A
SCHEMBL13059001 0.78 TRPV3 (0.49) MAOAMAOBMAPTL3MBTL1NPC1
SCHEMBL29432773 0.77 BTK (0.49) MAOAMAPTNPC1RAB9AMAPK1
SCHEMBL1536655 0.77 BTK (0.49) MAOAMAPTNPC1RAB9AMAPK1
SCHEMBL24754816 0.76 TRPV3 (0.57) MAOBMAPTL3MBTL1TRPV3PKM

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-118271299-A Lactam compound, and preparation method and application thereof 广州市联瑞制药有限公司 2024-07-02 CN disclosed
US-9012651-B2 TRPV3 modulators ABBVIE INC. (US) 2015-04-21 US disclosed
WO-2012129491-A1 TRPV3 MODULATORS ABBOTT LABORATORIES (US) 2012-09-27 WO disclosed
US-20120245124-A1 TRPV3 Modulators ABBOTT LABORATORIES (US) 2012-09-27 US disclosed
US-20060106070-A1 Novel pyridine-based metal chelators as antiviral agents BIOFLEXIS, LLC (US) 2006-05-18 US disclosed
US-20060100282-A1 Novel diaminopropane-based metal chelators as antiviral agents BIOFLEXIS, LLC (US) 2006-05-11 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 (3 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-20120245124-A1 TRPV3 Modulators TRPV3, TRPV2, TRPV1 MAOA 3476/4885MAOB 3078/4885MAPT 3335/4885
US-20060106070-A1 Novel pyridine-based metal chelators as antiviral agents SLC39A7, SLC7A1, SLC30A7 MAOA 1146/4885MAOB 445/4885MAPT 4358/4885
US-20060100282-A1 Novel diaminopropane-based metal chelators as antiviral agents SLC7A1, AOC1, APEH MAOA 800/4885MAOB 463/4885MAPT 4840/4885

“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.