SCHEMBL7866080

SCHEMBL7866080

C=CCP(CC=C)P(CC=C)CC=C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL29587 0.73 TSHR (0.33) TSHRALDH1A1
Bromide SCHEMBL1653733 0.70 TSHR (0.31) TSHRALDH1A1
SCHEMBL569476 0.70 TSHR (0.31) TSHRALDH1A1
Hydrochloric Acid SCHEMBL15569338 0.70 TSHR (0.31) TSHRALDH1A1
SCHEMBL9413747 0.70 TSHR (0.31) TSHRALDH1A1
Hydrochloric Acid SCHEMBL709785 0.70 TSHR (0.31) TSHRALDH1A1
Charcoal, Activated SCHEMBL7745778 0.70 TSHR (0.31) TSHRALDH1A1
Hydrochloric Acid SCHEMBL15569340 0.70 TSHR (0.31) TSHRALDH1A1
Water SCHEMBL4565708 0.70 TSHR (0.31) TSHRALDH1A1
SCHEMBL10716028 0.70 TSHR (0.31) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001096349-A1 WATER SOLUBLE PHOSPHINES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2001-12-20 WO disclosed
US-6307098-B1 TRIS(PHOSPHONOPHENYL)PHOSPHINES AND DERIVATIVES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2001-10-23 US disclosed
EP-0532124-B1 Polymer separation SHELL INT RESEARCH (NL) 1997-12-17 EP disclosed
EP-0532124-A1 Polymer separation SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-03-17 EP disclosed
EP-0316610-B1 LUBRICATING OIL COMPOSITION IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-07-08 EP disclosed
EP-0316610-A1 Lubricating oil composition IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-05-24 EP disclosed
US-4832867-A Lubricating oil composition IDEMITSU KOSAN CO., LTD. (JP) 1989-05-23 US disclosed