SCHEMBL10174229

SCHEMBL10174229

CCC(C)c1cccc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.56
HDAC2 Q92769 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
ANPEP P15144 1/20 0.56
ENPEP Q07075 1/20 0.56
ALDH1A1 P00352 2/20 0.52
PARP1 P09874 1/20 0.48
MAPT P10636 2/20 0.47
PTGS1 P23219 2/20 0.47
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
PTGS2 P35354 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RECQL P46063 1/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
PMP22 Q01453 1/20 0.47

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
SCHEMBL12247344 1.00 HDAC4 (0.56) HDAC4HDAC2HDAC8ANPEPENPEP
SCHEMBL12247341 1.00 HDAC4 (0.56) HDAC4HDAC2HDAC8ANPEPENPEP
SCHEMBL14201846 0.86 PTGS1 (0.66) HDAC4HDAC2HDAC8ALDH1A1MAPT
SCHEMBL6838300 0.86 ANPEP (0.53) ANPEPENPEPALDH1A1PARP1MAPT
SCHEMBL1320105 0.86 ANPEP (0.56) ANPEPENPEPALDH1A1PARP1MAPT
SCHEMBL2758518 0.86 HDAC4 (0.56) HDAC4HDAC2HDAC8ALDH1A1MAPT
SCHEMBL9843117 0.85 ANPEP (0.59) ANPEPENPEPALDH1A1MAPTPTGS1
Ammonia Solution, Strong SCHEMBL6014470 0.85 ANPEP (0.51) ANPEPENPEPALDH1A1PARP1MAPT
SCHEMBL7357638 0.84 ANPEP (0.54) ANPEPENPEPALDH1A1PARP1MAPT
SCHEMBL4752633 0.84 ANPEP (0.58) ANPEPENPEPALDH1A1PARP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2021-07-08 US disclosed
US-9765018-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-19 US disclosed
US-9766547-B2 Pattern forming method, actinic ray-sensitive or radiation-sensitive resin composition, resist film, method of manufacturing electronic device using the same, and electronic device FUJIFILM CORPORATION (JP) 2017-09-19 US disclosed
US-9750740-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors Kanos Pharmaceuticals, Inc. (US) 2017-09-05 US disclosed
US-9676763-B2 Method of treating Ebola PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-06-13 US disclosed
US-20170095476-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2017-04-06 US disclosed
US-20170066791-A1 LXR AGONISTS AND USES THEREOF INSPIRNA, INC. 2017-03-09 US disclosed
US-9440949-B2 Diacylglycerol acyltransferase 2 inhibitors PFIZER INC. (US) 2016-09-13 US disclosed
US-9411230-B2 Pattern forming method, electron beam-sensitive or extreme ultraviolet-sensitive composition, resist film, method for manufacturing electronic device using the same, and electronic device FUJIFILM CORPORATION (JP) 2016-08-09 US disclosed
US-20160011517-A1 PATTERN FORMING METHOD, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, METHOD OF MANUFACTURING ELECTRONIC DEVICE USING THE SAME, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2016-01-14 US disclosed
US-7955781-B2 Negative-working photosensitive material and negative-working planographic printing plate precursor FUJIFILM CORPORATION (JP) 2011-06-07 US disclosed
US-7935771-B2 Polymer having sulfonic acid group or sulfonic acid ester group and amide group, and toner for developing electrostatic latent image having the polymer CANON KABUSHIKI KAISHA (JP) 2011-05-03 US disclosed
US-20090233221-A1 NEGATIVE-WORKING PHOTOSENSITIVE MATERIAL AND NEGATIVE-WORKING PLANOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed
US-20090162773-A1 POLYMER HAVING SULFONIC ACID GROUP OR SULFONIC ACID ESTER GROUP AND AMIDE GROUP, AND TONER FOR DEVELOPING ELECTROSTATIC LATENT IMAGE HAVING THE POLYMER CANON KABUSHIKI KAISHA (JP) 2009-06-25 US disclosed
US-20090087787-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF PRODUCING A COPOLYMER USED THEREIN FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090087780-A1 NEGATIVE-WORKING PHOTOSENSITIVE MATERIAL AND NEGATIVE-WORKING PLANOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-7498116-B2 Resist composition and pattern formation method using the same FUJIFILM CORPORATION (JP) 2009-03-03 US disclosed
US-7498116-B2 Resist composition and pattern formation method using the same FUJIFILM CORPORATION (JP) 2009-03-03 US disclosed
US-20080241750-A1 RESIST COMPOSITION AND PATTERN FORMATION METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080241750-A1 RESIST COMPOSITION AND PATTERN FORMATION METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-10-02 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 (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-20170095476-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC4 701/4885HDAC2 576/4885HDAC8 1335/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A HDAC4 701/4885HDAC2 576/4885HDAC8 1335/4885
US-20170066791-A1 LXR AGONISTS AND USES THEREOF NR1H3, NR1H2, NR1H4 HDAC4 700/4885HDAC2 1579/4885HDAC8 739/4885
US-20090162773-A1 POLYMER HAVING SULFONIC ACID GROUP OR SULFONIC ACID ESTER GROUP AND AMIDE GROUP, AND TONER FOR DEVELOPING ELECTROSTATIC LATENT IMAGE HAVING THE POLYMER OXSR1, OXGR1, ARSA HDAC4 1203/4885HDAC2 1029/4885HDAC8 755/4885

“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.