Sugi Predict

Sugi Predict / Compounds / SCHEMBL1543425

SCHEMBL1543425

SCHEMBL1543425

CCNCCN(CC)CCN

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 3/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ CYP1A2 P05177 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TP53 P04637 1/20 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
SCHEMBL11341727 0.96 CYP2C19 (0.40) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL17355390 0.91 CYP2C19 (0.41) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL16144553 0.90 CYP2C19 (0.45) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL3972281 0.88 CYP2C19 (0.43) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL10123924 0.86 CYP2C19 (0.54) CYP2C19CYP2C9MEN1KMT2ACYP1A2
SCHEMBL9079152 0.85 CYP2C19 (0.41) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL24193268 0.84 CYP2C19 (0.52) CYP2C19CYP2C9MEN1KMT2ACYP1A2
SCHEMBL10123895 0.84 CYP2C19 (0.52) CYP2C19CYP2C9MEN1KMT2ACYP1A2
SCHEMBL22908466 0.84 CYP2C19 (0.47) CYP2C19CYP2C9MEN1KMT2AGLA
SCHEMBL4192702 0.83 CYP2C19 (0.39) CYP2C19MEN1KMT2AGLACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2175709-B1 SEED TREATMENT METHODS BASF SE (DE) 2013-06-19 — — EP disclosed
US-20130123108-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER BASF SE (DE) 2013-05-16 — — US disclosed
US-20110257284-A1 PROCESS FOR PRODUCING FLAME-RETARDANT PU FOAMS BASF SE (DE) 2011-10-20 — — US disclosed
US-20110105333-A1 Seed Treatment Compositions and Methods BASF SE (DE) 2011-05-05 — — US disclosed
EP-2308460-A1 Composition comprising active agents and at least one nitrogen-containing hyper-branched polymer BASF SE (DE) 2011-04-13 — — EP disclosed
US-20090257960-A1 NEUTRALIZED ACID GROUP-CONTAINING POLYMERS AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2009-10-15 — — US disclosed
EP-1773906-B1 CROSS-LINKED POLYTETRAHYDROFURAN-CONTAINING POLYURETHANES BASF SE (DE) 2009-04-29 — — EP disclosed
US-20090081137-A1 Crosslinked Polytetrahydrofuran-Containing Polyurethanes BASF AKTIENGESELLSCHAFT (DE) 2009-03-26 — — US disclosed
EP-2023892-A1 NEUTRALIZED ACID GROUP-CONTAINING POLYMERS AND THE USE THEREOF BASF SE (DE) 2009-02-18 — — EP disclosed
US-20090041813-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 — — US disclosed
WO-2001016200-A1 COSMETIC BASED ON OLIGOMERS AND POLYMERS CONTAINING URETHANE AND/OR UREA FUNCTIONAL GROUP BASF AKTIENGESELLSCHAFT (DE) 2001-03-08 — — WO disclosed
US-5914072-A DISPERSANTS FOR SOLIDS; FOR USE IN PAINTS, INKS BASF AKTIENGESELLSCHAFT (DE) 1999-06-22 — — US disclosed
US-5863879-A POLYMER IS FORMED BY REACTING A POLYMER CONTAINING VINYLAMINE UNIT WITH COMPOUNDS CONTAINING ALDEHYDE OR KETO GROUPS AND OPTIONAL OTHER AMINE OR ALOCHOL CONTAINING COMPOUNDS SUCH AS AMINAL, HEMIAMINAL OR AMINAL ACETATE BASF AKTIENGESELLSCHAFT (DE) 1999-01-26 — — US disclosed
EP-0756618-B1 DYE-TRANSFER INHIBITORS FOR DETERGENTS BASF AG (DE) 1998-08-12 — — EP disclosed
EP-0759440-A2 Phosphoric acid esters BASF AKTIENGESELLSCHAFT (DE) 1997-02-26 — — EP disclosed
EP-0756618-A1 DYE-TRANSFER INHIBITORS FOR DETERGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-02-05 — — EP disclosed
WO-1995029221-A1 DYE-TRANSFER INHIBITORS FOR DETERGENTS BASF AKTIENGESELLSCHAFT (DE) 1995-11-02 — — WO disclosed
WO-1994024361-A1 USE OF ALKOXYLATED POLYAMINES AND THEIR N-OXIDES, AS WELL AS THEIR PARTIAL AMIDES WITH CARBOXYLIC ACIDS, AS LEATHER DYEING AUXILIARY AGENTS BASF AKTIENGESELLSCHAFT (DE) 1994-10-27 — — WO disclosed
US-4179469-A Preparation of amines UOP INC. (US) 1979-12-18 — — US disclosed
US-3992307-A BIS-PHOSPHORAMIDE CHEVRON RESEARCH COMPANY (US) 1976-11-16 — — 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 (5 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-20090081137-A1 Crosslinked Polytetrahydrofuran-Containing Polyurethanes PUF60, MACF1, FKBP5 CYP2C19 312/4885CYP2C9 333/4885MEN1 3299/4885
US-20110105333-A1 Seed Treatment Compositions and Methods PTK2, BROX, FYN CYP2C19 3575/4885CYP2C9 4152/4885MEN1 4240/4885
US-20090257960-A1 NEUTRALIZED ACID GROUP-CONTAINING POLYMERS AND THE USE THEREOF PARG, PUF60, PARN CYP2C19 2844/4885CYP2C9 3410/4885MEN1 575/4885
US-20130123108-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER NOS1, NOS3, NPSR1 CYP2C19 4226/4885CYP2C9 4764/4885MEN1 1633/4885
US-20090041813-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER NOS1, NOS3, NPSR1 CYP2C19 4226/4885CYP2C9 4764/4885MEN1 1633/4885

“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.