SCHEMBL6328566

SCHEMBL6328566

NCCN1CCN(C(=O)CO)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.54
SIGMAR1 Q99720 3/20 0.44
TSHR P16473 2/20 0.38
HTR1A P08908 2/20 0.38
HTR7 P34969 2/20 0.38
GAA P10253 1/20 0.38
AKR1C3 P42330 1/20 0.37
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HRH2 P25021 1/20 0.35
HRH1 P35367 1/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL14012786 0.83 TSHR (0.51) TSHRHTR1AHTR7GAAAKR1C3
SCHEMBL24803014 0.83 GAA (0.40) ALOX15SIGMAR1TSHRGAAAKR1C3
SCHEMBL31563812 0.82 ALOX15 (0.52) ALOX15SIGMAR1ALDH1A1KMT2AACE2
SCHEMBL488806 0.82 ALOX15 (0.52) ALOX15SIGMAR1TSHRHTR1AHTR7
SCHEMBL7413697 0.82 ALOX15 (0.52) ALOX15SIGMAR1TSHRGAAMEN1
SCHEMBL12120407 0.81 ALOX15 (0.46) ALOX15SIGMAR1TSHRGAAALDH1A1
SCHEMBL3428795 0.79 SIGMAR1 (0.41) ALOX15SIGMAR1TSHRHTR1AHTR7
SCHEMBL8642977 0.79
SCHEMBL10972781 0.79 ALDH1A1 (0.50) ALOX15TSHRGAAAKR1C3HSD17B10
SCHEMBL12120414 0.79 GAA (0.68) ALOX15SIGMAR1TSHRGAAHSD17B10

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
US-6599902-B2 For treating or preventing a protein kinase related disorder SUGEN, INC. 2003-07-29 US claimed
US-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. 2003-07-03 US claimed
US-11236122-B2 Triterpene amine derivatives DFH THERAPEUTICS (US) 2022-02-01 US disclosed
US-20210253627-A1 TRITERPENE AMINE DERIVATIVES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2021-08-19 US disclosed
US-20140221455-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR Verva Pharmaceuticals, Inc. (AU) 2014-08-07 US disclosed
US-20050282733-A1 Differentiation modulating agents and uses therefor VERVA PHARMACEUTICALS PTY LTD (AU) 2005-12-22 US disclosed
US-6861418-B2 4-aryl substituted indolinones SUGEN, INC. (US) 2005-03-01 US disclosed
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors SUGEN, INC. 2004-09-23 US disclosed
US-20040157909-A1 4-Aryl substituted indolinones SUGEN, INC. 2004-08-12 US disclosed
US-6677368-B2 4-aryl substituted indolinones SUGEN, INC. 2004-01-13 US disclosed
US-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. 2003-07-03 US disclosed
US-20030069297-A1 4-aryl substituted indolinones SUGEN, INC. 2003-04-10 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 (7 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-20210253627-A1 TRITERPENE AMINE DERIVATIVES BET1, PGGT1B, NFATC1 ALOX15 441/4885SIGMAR1 1936/4885TSHR 4117/4885
US-20030069297-A1 4-aryl substituted indolinones CDK5, CAMK4, TNK2 ALOX15 3695/4885SIGMAR1 2259/4885TSHR 1749/4885
US-20040157909-A1 4-Aryl substituted indolinones CDK5, CAMK4, TNK2 ALOX15 3695/4885SIGMAR1 2259/4885TSHR 1749/4885
US-20050282733-A1 Differentiation modulating agents and uses therefor FGF1, FABP4, FGF2 ALOX15 199/4885SIGMAR1 4750/4885TSHR 2056/4885
US-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS DMPK, ADK, MAP3K20 ALOX15 2829/4885SIGMAR1 4039/4885TSHR 3115/4885
US-11236122-B2 Triterpene amine derivatives BET1, PGGT1B, NFATC1 ALOX15 441/4885SIGMAR1 1936/4885TSHR 4117/4885
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors MAP3K15, MAP3K20, MAP3K19 ALOX15 3186/4885SIGMAR1 2250/4885TSHR 2444/4885

“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.