SCHEMBL5845203

SCHEMBL5845203

CCCCCCCCCCCCCCCC#C[C]=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 7/20 0.55
PTPN7 P35236 5/20 0.55
SELP P16109 1/20 0.49
RECQL P46063 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
MCL1 Q07820 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
EPHX2 P34913 1/20 0.38

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
SCHEMBL338644 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL5845029 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL2395804 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL4148858 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL5845890 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL4130261 1.00 HMGCR (0.55) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL2393399 0.97
SCHEMBL6408336 0.91 HMGCR (0.57) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL10777606 0.91 HMGCR (0.57) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL953771 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015209-B2 Hair-growing agent KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-03-21 US disclosed
US-20040266730-A1 Hair-growing agent KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-12-30 US disclosed
EP-1214928-A1 HAIR GROWTH STIMULANTS KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-06-19 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 (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-20040266730-A1 Hair-growing agent PHOSPHO1, LPAR1, LPCAT3 HMGCR 1036/4885PTPN7 3364/4885SELP 4728/4885

“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.