SCHEMBL177295

SCHEMBL177295

CCCCn1cc(C=O)cn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
CTSD P07339 1/20 0.33
BACE1 P56817 1/20 0.33
BACE2 Q9Y5Z0 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TOP2A P11388 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
GAA P10253 1/20 0.31
AMY1A P0DUB6 1/20 0.30

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
SCHEMBL18586379 0.95 L3MBTL1 (0.40) L3MBTL1
SCHEMBL25403222 0.93 L3MBTL1 (0.39) L3MBTL1
SCHEMBL1197473 0.89 L3MBTL1 (0.51) L3MBTL1MAPTTDP1KDM4EALDH1A1
SCHEMBL3321417 0.82 PDK2 (0.36) L3MBTL1MAPTTDP1ALDH1A1HDAC2
SCHEMBL125993 0.81
SCHEMBL24346253 0.79 L3MBTL1 (0.36) L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL122032 0.78 KIT (0.36) L3MBTL1MAPTTDP1HDAC1HDAC2
SCHEMBL1436338 0.78 PSD (0.34) L3MBTL1HDAC2
SCHEMBL31115874 0.78 MAPT (0.33) L3MBTL1MAPTTDP1HDAC2
SCHEMBL4416507 0.77 PTGER4 (0.38) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103772282-B A kind of preparation method of the 3-tertiary butyl-1H-pyrazoles-4-formaldehyde SHANGHAI BEPHARM CO., LTD. (CN) 2015-09-23 CN claimed
CN-103772282-A Method for preparing 3-tertiary butyl-1H-pyrazole-4-formaldehyde BIDE PHARMATECH LTD 2014-05-07 CN claimed
US-12181833-B2 Photoresponsive polymer Konica Minolta, Inc. (JP) 2024-12-31 US disclosed
US-11762276-B2 Photoresponsive compound Konica Minolta, Inc. (JP) 2023-09-19 US disclosed
US-20220043333-A1 PHOTORESPONSIVE COMPOUND Konica Minolta, Inc. (JP) 2022-02-10 US disclosed
CN-108137513-A Pyrimidine derivatives ASKA 制药株式会社 2018-06-08 CN disclosed
US-9707205-B2 S1P receptors modulators and their use thereof AKAAL PHARMA PTY LTD. (AU) 2017-07-18 US disclosed
CN-102186845-B S1P receptor modulators and their purposes 阿卡制药有限公司 2016-09-07 CN disclosed
EP-2344484-B1 S1P RECEPTORS MODULATORS AND USE THEREOF AKAAL PHARMA PTY LTD (AU) 2016-06-08 EP disclosed
US-20160038455-A1 S1P RECEPTORS MODULATORS AND THEIR USE THEREOF AKAAL PHARMA PTY LTD. (AU) 2016-02-11 US disclosed
US-9193716-B2 S1P receptors modulators and their use thereof AKAAL PHARMA PTY LTD. (AU) 2015-11-24 US disclosed
US-20140066427-A1 S1P Receptors Modulators and Their Use Thereof AKAAL PHARMA PTY LTD. (AU) 2014-03-06 US disclosed
US-8592399-B2 S1P receptors modulators and their use thereof AKAAL PHARMA PTY LTD. (AU) 2013-11-26 US disclosed
CN-101484448-B Pyrazole alkanamide substituted thiophenes as AMPA potentiators ORGANON NV 2012-03-14 CN disclosed
US-20110318388-A1 S1P Receptors Modulators and Their Use Thereof AKAAL PHARMA PTY LTD (AU) 2011-12-29 US disclosed
CN-102186845-A S1p receptors modulators and their use thereof AKAAL PHARMA PTY LTD 2011-09-14 CN disclosed
EP-2344484-A1 S1P RECEPTORS MODULATORS AND THEIR USE THEREOF Akaal Pharma Pty Ltd (AU) 2011-07-20 EP disclosed
WO-2010043000-A1 S1P RECEPTORS MODULATORS AND THEIR USE THEREOF AKAAL PHARMA PTY LTD (AU) 2010-04-22 WO disclosed
CN-101687790-A Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2(MGLU2 receptor) ABBOTT GMBH & CO KG 2010-03-31 CN disclosed
CN-101484448-A Pyrazolealkanamide substituted thiophenes as AMPA potentiators ORGANON NV (NL) 2009-07-15 CN 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-20160038455-A1 S1P RECEPTORS MODULATORS AND THEIR USE THEREOF S1PR1, S1PR5, S1PR2 L3MBTL1 3695/4885CTSD 2766/4885BACE1 1353/4885
US-20110318388-A1 S1P Receptors Modulators and Their Use Thereof S1PR1, S1PR5, S1PR2 L3MBTL1 3695/4885CTSD 2766/4885BACE1 1353/4885
US-20140066427-A1 S1P Receptors Modulators and Their Use Thereof S1PR1, S1PR2, S1PR5 L3MBTL1 4256/4885CTSD 2986/4885BACE1 2119/4885

“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.