SCHEMBL10242397

SCHEMBL10242397

Cc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 11/20 0.61
ADORA2B P29275 2/20 0.61
NPSR1 Q6W5P4 5/20 0.60
LMNA P02545 4/20 0.60
HTT P42858 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MAPT P10636 1/20 0.60
ADORA1 P30542 7/20 0.60
ADORA2A P29274 4/20 0.60
ALDH1A1 P00352 3/20 0.59
ALOX5 P09917 3/20 0.57
TDP1 Q9NUW8 1/20 0.57
NTRK1 P04629 1/20 0.55

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
SCHEMBL27729658 0.92 NTRK1 (0.59) ADORA3ADORA2BNPSR1LMNAHTT
SCHEMBL275863 0.85 NTRK1 (0.59) HTTSMN1; SMN2ALDH1A1ALOX5NTRK1
SCHEMBL956697 0.83 CDC7 (0.61) HTTSMN1; SMN2MAPTALDH1A1ALOX5
SCHEMBL10242392 0.83 KMT2A (0.58) NPSR1LMNASMN1; SMN2ALDH1A1NTRK1
SCHEMBL27972473 0.81 RAB9A (0.63) SMN1; SMN2MAPTALDH1A1
SCHEMBL165773 0.81 ADORA3 (0.61) ADORA3ADORA2BNPSR1LMNAHTT
SCHEMBL16440392 0.80 ADORA2A (0.73) ADORA3LMNAMAPTADORA1ADORA2A
SCHEMBL276196 0.79 NTRK1 (0.57) NPSR1LMNAHTTSMN1; SMN2MAPT
SCHEMBL10242419 0.79 ALDH1A1 (0.61) NPSR1HTTSMN1; SMN2MAPTALDH1A1
SCHEMBL17208610 0.79 CCNA2 (0.66) LMNAMAPTALDH1A1TDP1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263657-B2 Blocking neurokinins; using a benzene compound containing hydroxy or acetoxy group; antiinflammatory agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-09-11 US disclosed
US-8263657-B2 Blocking neurokinins; using a benzene compound containing hydroxy or acetoxy group; antiinflammatory agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-09-11 US disclosed
US-8097759-B2 Inflammatory cytokine release inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-01-17 US disclosed
US-8097759-B2 Inflammatory cytokine release inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-01-17 US disclosed
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2010-10-28 US disclosed
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2010-10-28 US disclosed
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-07-30 US disclosed
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-07-30 US disclosed
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-12-25 US disclosed
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-12-25 US disclosed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US disclosed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US disclosed
EP-1847263-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-24 EP disclosed
EP-1844766-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-17 EP disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185110-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185110-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070042997-A1 Medicament for treatment of dermal pigmentation INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-02-22 US disclosed
US-20070042997-A1 Medicament for treatment of dermal pigmentation INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-02-22 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 (7 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-20080090779-A1 ANTIALLERGIC AGENTS NAT1, EPX, HRH2 ADORA3 736/4885ADORA2B 581/4885NPSR1 237/4885
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A ADORA3 3736/4885ADORA2B 1951/4885NPSR1 420/4885
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A ADORA3 3778/4885ADORA2B 1807/4885NPSR1 428/4885
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A ADORA3 3778/4885ADORA2B 1807/4885NPSR1 428/4885
US-20070185110-A1 Antiallergic agents NAT1, EPX, AHR ADORA3 640/4885ADORA2B 472/4885NPSR1 243/4885
US-20070185059-A1 Antiallergic agents NAT1, EPX, AHR ADORA3 696/4885ADORA2B 516/4885NPSR1 277/4885
US-20070042997-A1 Medicament for treatment of dermal pigmentation TYR, XDH, XPA ADORA3 1228/4885ADORA2B 1445/4885NPSR1 2012/4885

“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.