SCHEMBL2332319

SCHEMBL2332319

O=C(O)[C@H](CCS)N(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.42
ADRA2C P18825 1/20 0.40
FOLH1 Q04609 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CTRB1 P17538 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL2326683 0.87 MLYCD (0.44) MLYCDADRA2CFOLH1SMN1; SMN2RAB9A
SCHEMBL2328440 0.82 KMT2A (0.47) FOLH1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL10861618 0.81 MLYCD (0.45) MLYCDADRA2CSMN1; SMN2RAB9AL3MBTL1
SCHEMBL27888110 0.81 MLYCD (0.45) MLYCDADRA2CSMN1; SMN2RAB9AL3MBTL1
SCHEMBL27372764 0.81 NPC1 (0.44) FOLH1RAB9AALDH1A1NPC1MAPT
SCHEMBL1387641 0.80 ADRA2C (0.54) MLYCDADRA2CSMN1; SMN2RAB9AL3MBTL1
SCHEMBL2327734 0.80 FOLH1 (0.41) FOLH1SMN1; SMN2RAB9ACTRB1ALDH1A1
SCHEMBL27440883 0.80 ADRA2C (0.54) MLYCDADRA2CSMN1; SMN2RAB9AL3MBTL1
SCHEMBL2331989 0.80 NPC1 (0.44) RAB9AL3MBTL1ALDH1A1LMNATP53
SCHEMBL31530763 0.80 FOLH1 (0.41) FOLH1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356979-B1 ANTI-WRINKLE AGENTS POLA CHEM IND INC (JP) 2017-10-25 EP disclosed
EP-3173063-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2017-05-31 EP disclosed
US-8835498-B2 Anti-wrinkle agents POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-16 US disclosed
US-20110245343-A1 ANTI-WRINKLE AGENTS POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 US disclosed
EP-2356979-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2011-08-17 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-20110245343-A1 ANTI-WRINKLE AGENTS GLA, H1-4, H1-3 MLYCD 4103/4885ADRA2C 2901/4885FOLH1 4850/4885

“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.