SCHEMBL11516409

SCHEMBL11516409

CC(C#N)c1nc2ccccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.57
▸ ALOX5 P09917 1/20 0.52
▸ MAPK9 P45984 7/20 0.51
▸ MAPK10 P53779 7/20 0.51
▸ HPGD P15428 2/20 0.50
▸ CASR P41180 1/20 0.49
▸ THRB P10828 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ MAPT P10636 1/20 0.44
▸ PAX8 Q06710 1/20 0.44
▸ NOD2 Q9HC29 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HIF1A Q16665 1/20 0.43

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
SCHEMBL62420 0.80 LOXL2 (0.66) LOXL2ALOX5HPGDCASRGAA
SCHEMBL2146969 0.80 LOXL2 (0.66) LOXL2ALOX5HPGDCASRGAA
SCHEMBL11515131 0.79 MAPK9 (0.55) LOXL2ALOX5MAPK9MAPK10HPGD
SCHEMBL9675088 0.78 LOXL2 (0.64) LOXL2ALOX5MAPK9MAPK10HPGD
SCHEMBL11514240 0.77 MAPK9 (0.52) LOXL2ALOX5MAPK9MAPK10HPGD
SCHEMBL7400010 0.77 HPGD (0.59) LOXL2ALOX5MAPK9MAPK10HPGD
SCHEMBL21318392 0.77 LOXL2 (0.62) LOXL2ALOX5HPGDCASRGAA
SCHEMBL21275558 0.77 LOXL2 (0.62) LOXL2ALOX5HPGDCASRGAA
SCHEMBL20072395 0.77 LOXL2 (0.62) LOXL2ALOX5MAPK9MAPK10HPGD
SCHEMBL12085830 0.77 HPGD (0.64) LOXL2ALOX5HPGDCASRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285526-A Fluorescent probe for detecting hydrogen phosphate ions and preparation method and application thereof 贵州民族大学 2023-12-26 — — CN disclosed
US-20200354576-A1 DYEING COMPOSITION, DYED PRODUCT, AND AZO COLORING AGENT FUJIFILM CORPORATION (JP) 2020-11-12 — — US disclosed
US-20090176761-A1 JNK Inhivitors for the Treatment of Endometriosis LABORATORIES SERONO SA (CH) 2009-07-09 — — US disclosed
US-20090176762-A1 JNK Inhibitors for Treatment of Skin Diseases LABORATOIRES SERONO SA (CH) 2009-07-09 — — US disclosed
US-4146712-A PROCESS FOR THE MANUFACTURE OF COUMARIN DYES CIBA-GEIGY CORPORATION (US) 1979-03-27 — — US disclosed
US-4113718-A Basic azo dyes CIBA-GEIGY CORPORATION (US) 1978-09-12 — — US disclosed
US-4064136-A FROM A NITRILE, AN ALCOHOL AND ORTHO-SUBSTITUTED AROMATIC AMINE CIBA-GEIGY AG (CH) 1977-12-20 — — 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 (3 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-20090176762-A1 JNK Inhibitors for Treatment of Skin Diseases MAPKAPK2, JUN, MAP3K13 LOXL2 1380/4885ALOX5 3196/4885MAPK9 33/4885
US-20090176761-A1 JNK Inhivitors for the Treatment of Endometriosis MAPKAPK2, MAP3K20, MAP3K6 LOXL2 3974/4885ALOX5 4095/4885MAPK9 35/4885
US-20200354576-A1 DYEING COMPOSITION, DYED PRODUCT, AND AZO COLORING AGENT CYP1B1, CYP1A1, NAT1 LOXL2 4335/4885ALOX5 1457/4885MAPK9 2222/4885

“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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