SCHEMBL319591

SCHEMBL319591

CCCC(=O)c1ccc(I)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.67
L3MBTL1 Q9Y468 3/20 0.60
HPGD P15428 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
STS P08842 1/20 0.51
HTR7 P34969 1/20 0.50
TPMT P51580 1/20 0.48
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
NPC1 O15118 1/20 0.44

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
SCHEMBL26254861 0.89 HSD17B3 (0.82) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL4936177 0.88 HSD17B3 (0.69) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL16422179 0.84 HSD17B3 (0.71) HSD17B3L3MBTL1STSHTR7
SCHEMBL661834 0.82 SMN1; SMN2 (0.57) HSD17B3L3MBTL1SMN1; SMN2TPMTCA1
SCHEMBL13670607 0.80 L3MBTL1 (0.61) HSD17B3L3MBTL1TPMTNPC1
SCHEMBL5543515 0.80 HSD17B3 (0.69) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL5458953 0.80 HSD17B3 (0.69) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL10277102 0.80 HSD17B3 (0.69) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL151228 0.80 HSD17B3 (1.00) HSD17B3L3MBTL1HPGDSMN1; SMN2STS
SCHEMBL507742 0.80 HSD17B3 (0.69) HSD17B3L3MBTL1HPGDSMN1; SMN2STS

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
WO-2019198489-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT, INSULATING MATERIAL, RESIN MATERIAL FOR SOLDER RESISTS AND RESIST MEMBER DIC株式会社 2019-10-17 WO disclosed
US-9650395-B2 Antibacterial compounds and methods for use PTC THERAPEUTICS, INC. (US) 2017-05-16 US disclosed
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
EP-2582701-B1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE ALTOS THERAPEUTICS LLC (US) 2016-11-02 EP disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20150080362-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2015-03-19 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
EP-2582701-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2013-04-24 EP disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 US disclosed
WO-2011160084-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2011-12-22 WO disclosed
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. 2009-08-06 US disclosed
EP-0788478-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-08-13 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 (4 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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 HSD17B3 277/4885L3MBTL1 2998/4885HPGD 720/4885
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE HAVCR2, SARS1, RPL35 HSD17B3 1404/4885L3MBTL1 3512/4885HPGD 3522/4885
US-20150080362-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE MRPL21, SLC11A2, CLPP HSD17B3 3833/4885L3MBTL1 321/4885HPGD 1279/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 HSD17B3 277/4885L3MBTL1 2998/4885HPGD 720/4885

“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.