SCHEMBL3551342

SCHEMBL3551342

CNn1ccc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.52
CDK4 P11802 4/20 0.45
CCND1 P24385 4/20 0.45
NOTUM Q6P988 1/20 0.44
SLC6A4 P31645 6/20 0.44
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
BIRC5 O15392 1/20 0.38

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
SCHEMBL6623448 0.78 SLC6A2 (0.49) SLC6A2CDK4CCND1NOTUMSLC6A4
SCHEMBL15707807 0.77 SLC6A2 (0.52) SLC6A2CDK4CCND1NOTUMSLC6A4
SCHEMBL10826333 0.77 SLC6A2 (0.52) SLC6A2CDK4CCND1NOTUMMAPK1
SCHEMBL28444469 0.77 SLC6A2 (0.47) SLC6A2CDK4CCND1NOTUMSLC6A4
Hydrochloric Acid SCHEMBL6258187 0.77 SLC6A2 (0.47) SLC6A2CDK4CCND1NOTUMSLC6A4
SCHEMBL6628128 0.74 SLC6A2 (0.73) SLC6A2CDK4CCND1NOTUMSLC6A4
SCHEMBL3626398 0.74 HTT (0.51) SLC6A2CDK4CCND1NOTUMMAPK1
SCHEMBL3976417 0.74 SLC6A2 (0.45) SLC6A2CDK4CCND1NOTUMSLC6A4
SCHEMBL10973432 0.74 NOTUM (0.55) SLC6A2CDK4CCND1NOTUMMAPK1
SCHEMBL30371592 0.74 NOTUM (0.55) SLC6A2CDK4CCND1NOTUMMAPK1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022000443-A1 METHODS AND COMPOSITIONS FOR TARGETING TREGS USING CCR8 INHIBITORS Nanjing Immunophage Biotech Co., Ltd. (CN) 2022-01-06 WO disclosed
EP-2004847-B1 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS PENTABASE APS (DK) 2017-05-03 EP disclosed
CN-103664996-A Indole derivative and preparation method thereof INST MEDICINAL BIOTECHNOLOGY 2014-03-26 CN disclosed
WO-2011097642-A1 EFFICIENT METHODS FOR Z- OR CIS-SELECTIVE CROSS-METATHESIS TRUSTEES OF BOSTON COLLEGE (US) 2011-08-11 WO disclosed
US-7838669-B2 Naphthalocyanine dye and method for producing the same FUJIFILM CORPORATION (JP) 2010-11-23 US disclosed
US-20070073053-A1 Naphthalocyanine dye and method for producing the same FUJI PHOTO FILM CO., LTD. 2007-03-29 US disclosed
EP-1035114-B1 Processes for the preparation of nitrogen-heterocyclic compounds TOSOH CORP (JP) 2004-11-24 EP disclosed
US-6346621-B1 INDOLE OR QUINOLINE COMPOUNDS SUBSTITUTED WITH AMINO COMPOUNDS ON NITROGEN TOSOH CORPORATION (JP) 2002-02-12 US disclosed
EP-1035114-A2 Nitrogen-heterocyclic compounds and process for production thereof TOSOH CORPORATION (JP) 2000-09-13 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 (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-20070073053-A1 Naphthalocyanine dye and method for producing the same RPL41, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAP1L1 SLC6A2 592/4885CDK4 3301/4885CCND1 345/4885

“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.