SCHEMBL7244289

SCHEMBL7244289

CSCCCOc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.62
HTR1B P28222 2/20 0.53
LTA4H P09960 2/20 0.53
CHRNB2 P17787 2/20 0.52
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CHRNA7 P36544 2/20 0.52
CHRNA4 P43681 2/20 0.52
DRD2 P14416 2/20 0.50
DRD4 P21917 2/20 0.50
TAAR1 Q96RJ0 1/20 0.50
ALDH1A1 P00352 1/20 0.50
RECQL P46063 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50

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
SCHEMBL11285757 0.89 KCNA3 (0.58) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL21367950 0.82 KCNA3 (0.68) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL6535231 0.82 KCNA3 (0.68) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL3099934 0.79 DRD4 (0.50) LTA4HCHRNA7DRD2DRD4ALDH1A1
SCHEMBL12015520 0.79 DRD2 (0.55) DRD2DRD4ALDH1A1DRD3L3MBTL1
SCHEMBL1025 0.78 KCNA3 (0.88) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL1490164 0.78 KCNA3 (1.00) KCNA3HTR1BLTA4HDRD2DRD4
SCHEMBL14814295 0.77 KCNA3 (0.36) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL3360240 0.77 KCNA3 (0.52) KCNA3HTR1BLTA4HCHRNB2CHRNB4
SCHEMBL497029 0.76 KCNA3 (0.94) KCNA3HTR1BLTA4HDRD2DRD4

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
EP-2711381-B1 NOVEL COMPOUND, COMPOSITION CONTAINING SAID COMPOUND, AND CURED PRODUCT MITSUI CHEMICALS INC (JP) 2020-02-05 EP disclosed
US-20100279509-A1 Silicon-based hardmask composition and process of producing semiconductor integrated circuit device using the same SAMSUNG SDI CO., LTD. (KR) 2010-11-04 US disclosed
US-20030229113-A1 Keratinocyte growth inhibitors and hydroxamic acid derivatives AKZO NOBEL N.V. (NL) 2003-12-11 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 (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-20030229113-A1 Keratinocyte growth inhibitors and hydroxamic acid derivatives FGF1, FGF2, EGFR KCNA3 2951/4885HTR1B 3638/4885LTA4H 3637/4885

“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.