SCHEMBL2449925

SCHEMBL2449925

CCCCCOc1ccc2ccccc2c1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.59
CNR1 P21554 5/20 0.59
CYP2C9 P11712 1/20 0.59
GAA P10253 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
PTPN11 Q06124 1/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CTSD P07339 1/20 0.47
MEN1 O00255 1/20 0.47
NR1I2 O75469 1/20 0.47
CHRM2 P08172 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADRA2A P08913 1/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47

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
SCHEMBL17509546 0.96 GAA (0.59) CNR2CNR1CYP2C9GAATDP1
SCHEMBL4340803 0.91 CNR1 (0.57) CNR2CNR1CYP2C9GAATDP1
SCHEMBL10935027 0.88 ALDH1A1 (0.52) CNR2CNR1TDP1LMNAALDH1A1
SCHEMBL17502715 0.86 NCEH1 (0.58) CNR2CNR1CYP2C9GAATDP1
SCHEMBL27777554 0.85 HTR1B (0.59) CNR2CNR1GAATDP1L3MBTL1
SCHEMBL503962 0.85 ALDH1A1 (0.61) L3MBTL1LMNAALDH1A1TSHRRAB9A
SCHEMBL30393029 0.85 ALDH1A1 (0.61) L3MBTL1LMNAALDH1A1TSHRRAB9A
SCHEMBL17502757 0.85 CNR2 (0.57) CNR2CNR1CYP2C9GAATDP1
SCHEMBL17502613 0.85 CNR2 (0.57) CNR2CNR1CYP2C9GAATDP1
SCHEMBL17502626 0.85 CNR2 (0.57) CNR2CNR1CYP2C9GAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0345869-A2 Thermotropic copolyester and process for preparing it and use thereof ENIRICERCHE S.p.A. (IT) 1989-12-13 EP claimed
JP-60064891-A None JP disclosed
JP-62059084-A None JP disclosed
JP-62113589-A None JP disclosed
US-8022072-B2 Azolylmethylidenehydrazine derivative and use thereof KAKEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-20 US disclosed
US-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-07-29 US disclosed
CN-101778828-A Azolylmethylenehydrazine derivatives and uses thereof KAKEN PHARMA CO LTD 2010-07-14 CN disclosed
EP-2168951-A1 AZOLYLMETHYLENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-03-31 EP disclosed
US-5326848-A Thermotropic liquid crystal polyester KURARAY CO., LTD. (JP) 1994-07-05 US disclosed
EP-0345869-A2 Thermotropic copolyester and process for preparing it and use thereof ENIRICERCHE S.p.A. (IT) 1989-12-13 EP disclosed
JP-S62113589-A THERMAL RECORDING MATERIAL RICOH CO LTD 1987-05-25 JP disclosed
JP-S6259084-A THERMAL RECORDING MATERIAL RICOH CO LTD 1987-03-14 JP disclosed
JP-S6064891-A THERMOSENSITIVE RECORDING MATERIAL RICOH CO LTD 1985-04-13 JP 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-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF ARSA, AHR, HRH2 CNR2 31/4885CNR1 67/4885CYP2C9 381/4885

“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.