SCHEMBL353792

SCHEMBL353792

OCCN(CCO)c1ccc(-c2ccc(-c3ccncc3)s2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 2/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HDAC9 Q9UKV0 1/20 0.41
▸ HDAC5 Q9UQL6 1/20 0.41
▸ APP P05067 5/20 0.40
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ PRF1 P14222 1/20 0.37
▸ ACKR3 P25106 1/20 0.36
▸ CNR1 P21554 1/20 0.36

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
SCHEMBL352860 0.81 NR1H2 (0.43) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL353986 0.80 PRKCI (0.46) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL356229 0.79 PRKCI (0.40) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL353810 0.79 PRKCI (0.40) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL1150091 0.78 CHRM5 (0.42) MAPTSMN1; SMN2
SCHEMBL7751921 0.74 MAPT (0.56) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL18193923 0.74 MAPT (0.48) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL10064549 0.73 APP (0.34) APPESR1ESR2
SCHEMBL8406452 0.72 HDAC3 (0.53) PRKCIHDAC3HDAC4HDAC1HDAC7
SCHEMBL8724864 0.72 HDAC3 (0.53) PRKCIHDAC3HDAC4HDAC1HDAC7

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-20120015399-A1 FLUORESCENT SOLVATOCHROMIC PIGMENT NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-19 — — US disclosed
US-20120015399-A1 FLUORESCENT SOLVATOCHROMIC PIGMENT NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-19 — — US disclosed
EP-2395055-A1 FLUORESCENT SOLVATOCHROMIC PIGMENT National University Corporation Hokkaido University (JP) 2011-12-14 — — 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-20120015399-A1 FLUORESCENT SOLVATOCHROMIC PIGMENT ANXA5, TRPV5, TRPC5 PRKCI 2894/4885HDAC3 1916/4885HDAC4 3654/4885

“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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