SCHEMBL278676

SCHEMBL278676

C=CCN(CC=C)c1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.47
ALDH1A1 P00352 3/20 0.45
ALOX15 P16050 1/20 0.45
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
HPGD P15428 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
CA14 Q9ULX7 1/20 0.39
TSHR P16473 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
Hydrochloric Acid SCHEMBL27897977 0.98 PTPN1 (0.46) PTPN1ALDH1A1ALOX15KMT2ACYP3A4
SCHEMBL11767364 0.90 AKR1C3 (0.44) PTPN1ALDH1A1ALOX15KMT2ACYP3A4
SCHEMBL89548 0.87 ALDH1A1 (0.50) PTPN1ALDH1A1KMT2ACYP3A4KDM4E
SCHEMBL11333394 0.85 PTPN1 (0.37) PTPN1ALDH1A1ALOX15KMT2ACYP3A4
SCHEMBL83996 0.85 AKR1C3 (0.46) PTPN1ALDH1A1CYP3A4SMN1; SMN2HPGD
SCHEMBL21084683 0.84 PTPN1 (0.44) PTPN1ALDH1A1ALOX15KMT2ACYP3A4
SCHEMBL655212 0.84 KDM4E (0.46) PTPN1ALDH1A1KMT2ACYP3A4KDM4E
SCHEMBL7152784 0.84 KDM4E (0.43) PTPN1ALDH1A1KMT2ACYP3A4KDM4E
Benzophenone SCHEMBL27852184 0.83 ALDH1A1 (0.45) PTPN1ALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL458514 0.83 TSHR (0.41) PTPN1ALDH1A1ALOX15KMT2ACYP3A4

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 1351 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110343579-A A kind of air preheater chemical 国网江西省电力有限公司电力科学研究院 2019-10-18 CN claimed
CN-105492971-B The method of the orientation of block copolymer mesoscopic structure is controlled by random copolymer 阿科玛法国公司 2019-09-10 CN claimed
CN-109970980-A One pack system addition type polysiloxane composition 埃肯有机硅(上海)有限公司 2019-07-05 CN claimed
CN-109845768-A A kind of paichongding composite insecticide and preparation method thereof of pair of honeybee shielding protection 华南农业大学 2019-06-07 CN claimed
CN-109797047-A A kind of less salt type ready denier oil acid imidazoline surfactant and preparation method thereof 上海发凯化工有限公司 2019-05-24 CN claimed
CN-109717207-A A kind of Nitenpyram composite insecticide and preparation method thereof of pair of honeybee shielding protection 华南农业大学 2019-05-07 CN claimed
CN-109699688-A A kind of efficient and environment-friendly type thimerosal 青岛海大智汇科技管理咨询有限公司 2019-05-03 CN claimed
CN-109652238-A A kind of antibiotic and sterilizing perfumed soap 金文华 2019-04-19 CN claimed
CN-109601560-A A kind of clothianidin composite insecticide and preparation method thereof of pair of honeybee shielding protection 华南农业大学 2019-04-12 CN claimed
CN-109548799-A A kind of imidaclothiz composite insecticide and preparation method thereof of pair of honeybee shielding protection 华南农业大学 2019-04-02 CN claimed
WO-2003080755-A2 RADIATION-CURABLE RESIN COMPOSITION FOR ADHESIVES DSM IP ASSETS B.V. (NL) 2003-10-02 WO claimed
US-20030137570-A1 Photoprotective and lightfastness-enhancing siloxanes XEROX CORPORATION 2003-07-24 US claimed
US-20030133886-A1 Photoprotective and lightfastness-enhancing siloxanes XEROX CORPORATION 2003-07-17 US claimed
US-20030119939-A1 Ink compositions containing quaternary-substituted lightfastness agents XEROX CORPORATION 2003-06-26 US claimed
US-6569511-B1 Polysiloxane having a hydrophilic moiety and a lightfastness moiety; ink jet coating XEROX CORPORATION 2003-05-27 US claimed
EP-1309666-A2 ADHESIVE COMPOSITION FOR OPTICAL DISKS DSM N.V. (NL) 2003-05-14 EP claimed
WO-2002014449-A2 ADHESIVE COMPOSITION FOR OPTICAL DISKS DSM N.V. (NL) 2002-02-21 WO claimed
CN-1194037-A Photochromic spirooxazines, compositions and articles containing such compounds CORNING INC (US) 1998-09-23 CN claimed
US-4699862-A ZINC OXIDE, PHTHALO CYANINE COMPOUND, HOLE TRANSPORTING MATERIAL, BINDER DAINIPPON INK AND CHEMICALS, INC. (JP) 1987-10-13 US claimed
US-4093577-A ESTERIFYING WITH AN UNSATURATED FATTY ACID A RESIN PRODUCED FROM A DIALKYLAMINOBENZOIC ACID OR A CARBOXY-CONTAINING BENZOPHENONE WITH A POLYBASIC ACID AND A POLYHYDRIC ALCOHOL TOYO INK MANUFACTURING CO., LTD. (JA) 1978-06-06 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030133886-A1 Photoprotective and lightfastness-enhancing siloxanes ITGA1, ITGB1, ITGB8 PTPN1 4389/4885ALDH1A1 443/4885ALOX15 1045/4885

“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.