SCHEMBL91167

SCHEMBL91167

O=C(Cl)c1ccc(CO)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
ALDH1A1 P00352 2/20 0.45
EPHX2 P34913 1/20 0.42
TSHR P16473 1/20 0.42
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
KMT2A Q03164 1/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HDAC1 Q13547 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
SCHEMBL1290930 0.82 KMT2A (0.58) ALDH1A1TSHRCA1CA2CA12
SCHEMBL7132233 0.82 HDAC1 (0.47) ALDH1A1CA1CA2KMT2AHDAC1
Ethylene Glycol SCHEMBL9217560 0.81 ALDH1A1 (0.50) ALDH1A1TSHRCA1CA2HPGD
SCHEMBL68148 0.81 ALDH1A1 (0.59) ALDH1A1TSHRCA1CA2CA12
SCHEMBL20587670 0.81 ALDH1A1 (0.59) ALDH1A1TSHRCA1CA2CA12
SCHEMBL186794 0.80 CA1 (0.64) ALDH1A1CA1CA2KMT2ASMN1; SMN2
SCHEMBL27335185 0.79 ALDH1A1 (0.41) ALDH1A1CA1CA2KMT2ASMN1; SMN2
Alcohol SCHEMBL29110704 0.79 ALDH1A1 (0.48) ALDH1A1TSHRCA1CA2CA12
SCHEMBL8186531 0.79 PRSS1 (0.52) PRSS1PRSS2PRSS3ALDH1A1EPHX2
Methylene Chloride SCHEMBL29223376 0.78 ALDH1A1 (0.52) ALDH1A1TSHRCA1CA2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111393748-A Silicon dioxide modified polypropylene antibacterial material and preparation method thereof 卢静 2020-07-10 CN claimed
WO-2023280177-A1 SMALL MOLECULE COMPOUND TARGETING BCL9/β-CATENIN INTERACTION 南通聚太生物科技有限公司 2023-01-12 WO disclosed
CN-111393748-A Silicon dioxide modified polypropylene antibacterial material and preparation method thereof 卢静 2020-07-10 CN disclosed
US-9776141-B2 Composite polyamide membrane post-treated with nitrous acid DOW GLOBAL TECHNOLOGIES LLC (US) 2017-10-03 US disclosed
US-9700524-B2 Pharmaceutical compositions comprising monoterpenes NEONC TECHNOLOGIES INC. (US) 2017-07-11 US disclosed
US-20170182467-A1 COMPOSITE POLYAMIDE MEMBRANE POST-TREATED WITH NITROUS ACID DOW GLOBAL TECHNOLOGIES LLC (US) 2017-06-29 US disclosed
US-20170088494-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES NATIONAL INSTITUTES OF HEALTH 2017-03-30 US disclosed
US-9529257-B2 Hard mask composition and method for forming pattern using same CHEIL INDUSTRIES, INC. (KR) 2016-12-27 US disclosed
US-9498448-B2 Pharmaceutical compositions comprising monoterpenes NeOne Technologies, Inc. (US) 2016-11-22 US disclosed
US-20160332942-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES UNIVERSITY OF SOUTHERN CALIFORNIA 2016-11-17 US disclosed
US-20110280860-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES NEONC TECHNOLOGIES INC. 2011-11-17 US disclosed
US-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS 2011-05-05 US disclosed
US-20110105547-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS 2011-05-05 US disclosed
US-20110042614-A1 CHIRAL COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND POLYMER NETWORKS DERIVED THEREFROM E.I.DU PONT DE NEMOURS AND COMPANY (US) 2011-02-24 US disclosed
US-20080176816-A1 Method of making and using an adenosine analogue ACADEMIA SINICA 2008-07-24 US disclosed
US-7345079-B2 Treatment of disorder related to low cyclic GMP levels YUNG SHIN PHARMACEUTICALS INDUSTRIAL CO., LTD (TW) 2008-03-18 US disclosed
EP-1499627-A2 NUCLEASE RESISTANT CHIMERIC OLIGONUCLEOTIDES ISIS Pharmaceuticals, Inc. (US) 2005-01-26 EP disclosed
US-20030175906-A1 Nuclease resistant chimeric oligonucleotides ISIS PHARMACEUTICALS, INC. 2003-09-18 US disclosed
US-20030158403-A1 Nuclease resistant chimeric oligonucleotides ISIS PHARMACEUTICALS, INC. 2003-08-21 US disclosed
WO-2003004602-A2 NUCLEASE RESISTANT CHIMERIC OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2003-01-16 WO 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 (9 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-20160332942-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES SQLE, DHPS, GGPS1 PRSS1 2335/4885PRSS2 2858/4885PRSS3 3085/4885
US-20080176816-A1 Method of making and using an adenosine analogue HTT, ADA, GDA PRSS1 4125/4885PRSS2 3693/4885PRSS3 2840/4885
US-20110105484-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC FLNA, FLNB, OPRK1 PRSS1 3044/4885PRSS2 3586/4885PRSS3 3295/4885
US-20110042614-A1 CHIRAL COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND POLYMER NETWORKS DERIVED THEREFROM THEM6, WEE1, NOTUM PRSS1 4745/4885PRSS2 4187/4885PRSS3 4193/4885
US-20110105547-A1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC FLNA, FLNB, OPRK1 PRSS1 3044/4885PRSS2 3586/4885PRSS3 3295/4885
US-20110280860-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES SQLE, DHPS, GGPS1 PRSS1 2335/4885PRSS2 2858/4885PRSS3 3085/4885
US-20030158403-A1 Nuclease resistant chimeric oligonucleotides RNASE1, DIS3, DCLRE1B PRSS1 2733/4885PRSS2 2286/4885PRSS3 1286/4885
US-20030175906-A1 Nuclease resistant chimeric oligonucleotides DIS3, RNASE1, DCLRE1B PRSS1 2595/4885PRSS2 1965/4885PRSS3 1135/4885
US-20170088494-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING MONOTERPENES SQLE, DHPS, GGPS1 PRSS1 2335/4885PRSS2 2858/4885PRSS3 3085/4885

“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.