SCHEMBL3757534

SCHEMBL3757534

CCCCCCCCCCCCOc1[c]cc[c]c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.38
TSHR P16473 2/20 0.34
PLA2G2A P14555 1/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LTA4H P09960 3/20 0.33
THRA P10827 2/20 0.33
THRB P10828 2/20 0.33
PLA2G4B P0C869 1/20 0.33
GBA1 P04062 1/20 0.32
CHUK O15111 1/20 0.32
DAPK3 O43293 1/20 0.32
JAK2 O60674 1/20 0.32
ROCK2 O75116 1/20 0.32
PRKCG P05129 1/20 0.32
CDK1 P06493 1/20 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
SCHEMBL6681542 1.00 NR5A1 (0.38) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL1543863 1.00 NR5A1 (0.38) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL4624291 0.92 LTA4H (0.33) NR5A1TSHRLTA4HTHRATHRB
SCHEMBL5453657 0.86
SCHEMBL4622609 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL4623426 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL1871053 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL15211843 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL4622605 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1
SCHEMBL4623189 0.82 NR5A1 (0.44) NR5A1TSHRPLA2G2ATP53ALDH1A1

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
US-20100310647-A1 Enzymatic Synthesis of Polymers UNIVERSITY OF MASSACHUSETTS (US) 2010-12-09 US claimed
US-20060094857-A1 Enzymatic synthesis of polymers ARMY, UNITED STATES AMERICA AS REPRESENTED BY THE SECRETARY OF THE 2006-05-04 US claimed
EP-0704094-B1 POLYMERS FOR OPTICAL DEVICES CAMBRIDGE DISPLAY TECH LTD (GB) 2001-08-08 EP claimed
WO-1994029883-A1 POLYMERS FOR OPTICAL DEVICES CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 1994-12-22 WO claimed

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-20100310647-A1 Enzymatic Synthesis of Polymers PNKP, MGAM, COASY NR5A1 4095/4885TSHR 4699/4885PLA2G2A 3260/4885

“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.