SCHEMBL4372384

SCHEMBL4372384

CC(N)CC(N)CC(C)N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.60
▸ TSHR P16473 2/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ ANPEP P15144 2/20 0.40
▸ ERAP2 Q6P179 1/20 0.40
▸ ERAP1 Q9NZ08 1/20 0.40
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ THPO P40225 1/20 0.38
▸ GMNN O75496 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ OPRM1 P35372 1/20 0.33
▸ ENPEP Q07075 2/20 0.31
▸ GABRP O00591 2/20 0.30
▸ GABRD O14764 2/20 0.30

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
SCHEMBL28007472 0.89 TSHR (0.69) ALDH1A1TSHRMAPK1ANPEPERAP2
SCHEMBL13777020 0.84 ALDH1A1 (0.45) ALDH1A1TSHRMAPK1ANPEPERAP2
SCHEMBL28772767 0.84 ALDH1A1 (0.45) ALDH1A1TSHRMAPK1ANPEPERAP2
SCHEMBL799854 0.84 ALDH1A1 (0.45) ALDH1A1TSHRMAPK1ANPEPERAP2
SCHEMBL24269491 0.82 — —
SCHEMBL12603758 0.82 — —
SCHEMBL635314 0.82 — —
SCHEMBL16556492 0.82 — —
SCHEMBL8181574 0.82 — —
SCHEMBL1774475 0.82 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009109492-A1 DYEING AUXILIARY CLARIANT INTERNATIONAL LTD (CH) 2009-09-11 — — WO claimed
EP-1468038-A1 METHOD FOR PRODUCING ALKALINE POLYCONDENSATION PRODUCTS CHT R. BEITLICH GmbH (DE) 2004-10-20 — — EP claimed
WO-2003062304-A1 METHOD FOR PRODUCING ALKALINE POLYCONDENSATION PRODUCTS CHT R. BEITLICH GMBH (DE) 2003-07-31 — — WO claimed
US-20190142798-A1 POLYMER-DES-ETHYL SUNITINIB CONJUGATES NEKTAR THERAPEUTICS 2019-05-16 — — US disclosed
US-9085715-B2 Process for assembling two surfaces or one surface with a molecule of interest COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2015-07-21 — — US disclosed
US-20090286308-A1 Process for assembling two surfaces or one surface with a molecule of interest COMMISSARIAT A L' ENERGIE ATOMIQUE 2009-11-19 — — US disclosed
WO-2008005752-A2 MODIFICATION OF SURFACES OF POLYMERIC ARTICLES BY MICHAEL ADDITION REACTION BAUSCH & LOMB INCORPORATED (US) 2008-01-10 — — WO disclosed
US-20080003259-A1 Modification of surfaces of polymeric articles by Michael addition reaction BAUSCH & LOMB INCORPORATED 2008-01-03 — — 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 (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-20190142798-A1 POLYMER-DES-ETHYL SUNITINIB CONJUGATES KDR, FLT4, FLT1 ALDH1A1 3041/4885TSHR 3176/4885MAPK1 3269/4885

“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.

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