SCHEMBL7542437

SCHEMBL7542437

C=C(C#N)C(=O)NCCCC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 2/20 0.42
▸ ACHE P22303 6/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ EPHX2 P34913 1/20 0.39
▸ ZDHHC20 Q5W0Z9 1/20 0.39
▸ ZDHHC2 Q9UIJ5 1/20 0.39

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
SCHEMBL7550275 0.94 EPHX1 (0.48) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL7550564 0.93 EPHX1 (0.52) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL7550565 0.93 EPHX1 (0.52) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL7546089 0.93 EPHX1 (0.52) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL7544676 0.93 EPHX1 (0.52) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL7548924 0.93 EPHX1 (0.52) EPHX1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL2669454 0.88 MCL1 (0.53) EPHX1SMN1; SMN2KDM4ELMNAHPGD
SCHEMBL7543397 0.87 ALDH1A1 (0.43) SMN1; SMN2KDM4ELMNAACHEALDH1A1
SCHEMBL7545107 0.85 EPHX2 (0.42) LMNAACHEALDH1A1TSHRMGLL
SCHEMBL7550207 0.84 TSHR (0.40) SMN1; SMN2KDM4ELMNAACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 — — US claimed
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 — — US disclosed
EP-0824316-A4 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 2001-01-17 — — EP disclosed
US-5767152-A USING A CYANOCARBOXYLIC ACID S.N. BIOTECH, INC. 1998-06-16 — — US disclosed
EP-0824316-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH Nielsen, Thor, B. (US) 1998-02-25 — — EP disclosed
WO-1996034526-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 1996-11-07 — — WO 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-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH AREG, NGF, HDGF EPHX1 2739/4885SMN1; SMN2 4736/4885KDM4E 4496/4885

“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.

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