SCHEMBL8001328

SCHEMBL8001328

C=CCCCC(C)C.[SiH3]Cl

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
EBP Q15125 2/20 0.32

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
SCHEMBL55744 0.92
Ammonia Solution, Strong SCHEMBL3112805 0.90
SCHEMBL1760678 0.84
SCHEMBL2844048 0.83 LMNA (0.59) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL399787 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL1904498 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL2936701 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL9220719 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL131602 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4
SCHEMBL104256 0.82 TSHR (0.52) TSHRALDH1A1LMNAMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023298-A1 BRIDGE FLUORENYL/INDENYL METALLOCENES AND THE USE THEREOF Phillips Petroleum Company (US) 2000-08-02 EP disclosed
EP-1023298-A4 BRIDGE FLUORENYL/INDENYL METALLOCENES AND THE USE THEREOF PHILLIPS PETROLEUM CO (US) 2000-08-02 EP disclosed
WO-1999014219-A1 BRIDGE FLUORENYL/INDENYL METALLOCENES AND THE USE THEREOF PHILLIPS PETROLEUM COMPANY (US) 1999-03-25 WO disclosed
US-5886202-A HAVING UNUSUAL EFFECTIVENESS AS CATALYSTS FOR THE POLYMERIZATION OF OLEFINS WHEN CERTAIN SUBSTITUENTS ARE AT THE 3 POSITION OF THE INDENE; HIGHER-MOLECULAR-WEIGHT POLYOLEFINS CHEVRON PHILLIPS CHEMICAL COMPANY LP 1999-03-23 US disclosed