SCHEMBL12378749

SCHEMBL12378749

Cc1ccc(C(c2ccc(C(=O)O)cc2)C(C)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
SRD5A2 P31213 4/20 0.52
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
LMNA P02545 3/20 0.45
AKR1C3 P42330 1/20 0.45
TP53 P04637 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
DAO P14920 1/20 0.42
TSHR P16473 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
KEAP1 Q14145 1/20 0.41

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
SCHEMBL12378763 0.84 TDP1 (0.59) ALDH1A1SMN1; SMN2LMNATP53MEN1
SCHEMBL13266932 0.84 TSHR (0.54) ALDH1A1SMN1; SMN2SRD5A2CES2CES1
SCHEMBL12378742 0.81 LMNA (0.41) SMN1; SMN2LMNAMEN1KMT2ATSHR
SCHEMBL22472195 0.80 TSHR (0.59) SRD5A2CES2CES1TP53RXRA
Terephthalic Acid SCHEMBL15994297 0.78 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2SRD5A2CES2CES1
SCHEMBL31192242 0.78 TSHR (0.60) ALDH1A1SMN1; SMN2SRD5A2CES2CES1
4-Methylbenzoic Acid SCHEMBL14723409 0.78 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2SRD5A2CES2CES1
4-Methylbenzoic Acid SCHEMBL7940172 0.78 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2SRD5A2CES2CES1
SCHEMBL12378739 0.78 CYP2D6 (0.56) ALDH1A1SMN1; SMN2LMNATSHRL3MBTL1
4-Methylbenzoic Acid SCHEMBL27936299 0.78 ALDH1A1 (0.94) ALDH1A1SMN1; SMN2SRD5A2CES2CES1

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-7994372-B2 Parylene variants and methods of synthesis and use SPECIALTY COATING SYSTEMS, INC. (US) 2011-08-09 US disclosed
US-20090186998-A1 PARYLENE VARIANTS AND METHODS OF SYNTHESIS AND USE SPECIALTY COATING SYSTEMS, INC. (US) 2009-07-23 US disclosed
US-7462750-B2 Parylene variants and methods of synthesis and use SPECIALTY COATING SYSTEMS, INC. (US) 2008-12-09 US disclosed
US-20070099019-A1 Parylene variants and methods of synthesis and use SPECIALTY COATING SYSTEMS, INC. (US) 2007-05-03 US 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 (2 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-20070099019-A1 Parylene variants and methods of synthesis and use CDC73, PARN, PFAS ALDH1A1 3048/4885SMN1; SMN2 3821/4885SRD5A2 3557/4885
US-20090186998-A1 PARYLENE VARIANTS AND METHODS OF SYNTHESIS AND USE CDC73, PARN, PFAS ALDH1A1 2365/4885SMN1; SMN2 3835/4885SRD5A2 3548/4885

“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.