SCHEMBL3336864

SCHEMBL3336864

NCC1(CN)CCOCC1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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 SCHEMBL7950262 0.97 USP2 (0.30) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL1192654 0.84 EPHX1 (0.33) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL1463811 0.84
SCHEMBL19650811 0.84
Sulfuric Acid SCHEMBL8782471 0.83 USP2 (0.32) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL1443404 0.82
Hydrochloric Acid SCHEMBL25212348 0.82
SCHEMBL4073419 0.82
SCHEMBL17526051 0.80
SCHEMBL20279957 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051387-B1 ANTICANCER PLATINUM (IV) COMPLEXES FOR ORAL ADMINISTRATION KOREA INST SCI & TECH (KR) 2003-04-23 EP claimed
EP-1051387-A1 ANTICANCER PLATINUM (IV) COMPLEXES FOR ORAL ADMINISTRATION KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2000-11-15 EP claimed
US-5998648-A PLATINUM CHELATE COMPOUND KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1999-12-07 US claimed
WO-1999033782-A1 ANTICANCER PLATINUM (IV) COMPLEXES FOR ORAL ADMINISTRATION KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1999-07-08 WO claimed
US-5665343-A POLYPHOSPHAZENE IL-YANG PHARM. CO., LTD (KR) 1997-09-09 US claimed
WO-1997012891-A1 POLYMERIC PLATINUM COMPLEX, PREPARATION THEREOF, AND ANTICANCER AGENT COMPRISING THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1997-04-10 WO claimed
US-5426203-A Antitumor agents having low toxicity KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1995-06-20 US claimed
EP-0232784-B1 (GEM-HETEROCYCLODIMETHANAMINE-N,N')PLATINUM COMPLEXES AMERICAN CYANAMID COMPANY (US) 1992-12-02 EP claimed
US-4937358-A Synthesis of cisplatin analogs AMERICAN CYANAMID COMPANY (US) 1990-06-26 US claimed
US-20210113712-A1 METHODS FOR PREPARING CELL TARGETING CONJUGATES AND CONJUGATES OBTAINABLE BY SAID METHODS LINXIS B V (NL) 2021-04-22 US disclosed
US-20210113712-A1 METHODS FOR PREPARING CELL TARGETING CONJUGATES AND CONJUGATES OBTAINABLE BY SAID METHODS LINXIS B V (NL) 2021-04-22 US disclosed
US-20200345862-A1 TRANSITION METAL-BASED FUNCTIONAL MOIETIES FOR PREPARING CELL TARGETING CONJUGATES LINXIS B V (NL) 2020-11-05 US disclosed
US-20200345862-A1 TRANSITION METAL-BASED FUNCTIONAL MOIETIES FOR PREPARING CELL TARGETING CONJUGATES LINXIS B V (NL) 2020-11-05 US disclosed
EP-2740738-B1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASE, PREPARATION METHODS AND USES THEREOF BEIJING FSWELCOME TECH DEVELOPMENT CO LTD (CN) 2018-03-28 EP disclosed
US-4937358-A Synthesis of cisplatin analogs AMERICAN CYANAMID COMPANY (US) 1990-06-26 US disclosed
US-4880790-A ANTICANCER, ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY (US) 1989-11-14 US disclosed
US-4870070-A ANTIEMETICS AMERICAN CYANAMID COMPANY (US) 1989-09-26 US disclosed
US-4808730-A Synthesis of cisplatin analogs AMERICAN CYANAMID COMPANY (US) 1989-02-28 US disclosed
EP-0296321-A1 Synthesis of cisplatinum analogs AMERICAN CYANAMID COMPANY (US) 1988-12-28 EP disclosed
EP-0232784-A2 (Gem-heterocyclodimethanamine-N,N')platinum complexes AMERICAN CYANAMID COMPANY (US) 1987-08-19 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 (2 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-20210113712-A1 METHODS FOR PREPARING CELL TARGETING CONJUGATES AND CONJUGATES OBTAINABLE BY SAID METHODS CD47, EPCAM, CD44 USP2 1987/4885ALDH1A1 1027/4885LMNA 2122/4885
US-20200345862-A1 TRANSITION METAL-BASED FUNCTIONAL MOIETIES FOR PREPARING CELL TARGETING CONJUGATES CD2, CD47, EPCAM USP2 2765/4885ALDH1A1 919/4885LMNA 3478/4885

“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.