SCHEMBL367948

SCHEMBL367948

CCCCCc1c[nH]c(CCCCC)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 10/20 0.50
PTGS2 P35354 3/20 0.45
CYP3A4 P08684 1/20 0.45
KMT2A Q03164 1/20 0.41
HTR1A P08908 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40

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
SCHEMBL12097192 0.94 HRH3 (0.44) GPR84PTGS2CYP3A4HTR1A
SCHEMBL4686292 0.91 GPR84 (0.44) GPR84PTGS2CYP3A4KMT2AHTR1A
SCHEMBL28902375 0.88 HRH3 (0.40) GPR84PTGS2CYP3A4HTR1A
SCHEMBL3420701 0.82 HRH3 (0.39) GPR84
SCHEMBL13103064 0.82 S1PR1 (0.46) GPR84
SCHEMBL13103053 0.82 S1PR1 (0.46) GPR84
SCHEMBL12097276 0.80 MPO (0.35) GPR84
SCHEMBL4562936 0.78 GPR84 (0.49) GPR84KMT2A
SCHEMBL3411576 0.77 PPARA (0.47) GPR84PTGS2CYP3A4
Iodide SCHEMBL3411569 0.77 HRH3 (0.38) GPR84HTR1AHTR1DHTR1B

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
EP-0487870-B1 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID CO (US) 1996-12-18 EP claimed
US-8097656-B2 Nitrogenated trans-stilbene analogs, method for the obtention and medical applications thereof Dominion Pharmakine S.L (ES) 2012-01-17 US disclosed
US-20110060038-A1 NITROGENATED TRANS-STILBENE ANALOGS, METHOD FOR THE OBTENTION AND MEDICAL APPLICATIONS THEREOF DOMINION PHARMAKINE S.L. (ES) 2011-03-10 US disclosed
US-20090298905-A1 Nitrogenatd trans-stilbene analogs, method for the obtention and medical applications thereof UNIVERSIDAD DEL PAIS VASCO (ES) 2009-12-03 US disclosed
EP-0487111-B1 A novel color-forming coupler and a silver halide color photographic material containing the same FUJI PHOTO FILM CO LTD (JP) 1996-05-15 EP disclosed
US-5260181-A Sharpness FUJI PHOTO FILM CO., LTD. (JP) 1993-11-09 US disclosed
EP-0487111-A1 A novel color-forming coupler and a silver halide color photographic material containing the same Fuji Photo Film Co., Ltd. (JP) 1992-05-27 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 (2 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-20090298905-A1 Nitrogenatd trans-stilbene analogs, method for the obtention and medical applications thereof TNNI3, TNNT2, INMT GPR84 1328/4885PTGS2 141/4885CYP3A4 1289/4885
US-20110060038-A1 NITROGENATED TRANS-STILBENE ANALOGS, METHOD FOR THE OBTENTION AND MEDICAL APPLICATIONS THEREOF TNNI3, TNNT2, NOS2 GPR84 1515/4885PTGS2 145/4885CYP3A4 1616/4885

“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.