SCHEMBL29587352

SCHEMBL29587352

c1cnc2c(c1)CC1CCCCC21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.36
HTR2C P28335 6/20 0.36
HTR2B P41595 6/20 0.36
HRH3 Q9Y5N1 5/20 0.36
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
OPRL1 P41146 3/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.33
CYP2D6 P10635 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL1698216 0.84 HDAC1 (0.40) KDM4EGAACYP2D6CYP3A4
SCHEMBL1698200 0.82 KDM4E (0.39) HTR2AHTR2CHTR2BHRH3KDM4E
SCHEMBL12379331 0.77 IDH1 (0.33) HTR2AHTR2CHTR2BHRH3
SCHEMBL3835964 0.72 OPRL1 (0.36) OPRL1
SCHEMBL25967564 0.70 NOS1 (0.37) KDM4EGAAOPRL1
SCHEMBL461946 0.69 HTR2A (0.54) HTR2AHTR2CHTR2BHRH3
SCHEMBL7545824 0.68 HTR2A (0.53) HTR2AHTR2CHTR2BHRH3
SCHEMBL29949831 0.67 PLAU (0.44) HTR2AHTR2CHTR2BHRH3
SCHEMBL14990041 0.67 PLAU (0.44) HTR2AHTR2CHTR2BHRH3
SCHEMBL9742041 0.67 CHRNA7 (0.44)

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
US-20230391790-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION TARO PHARMACEUTICALS INC. (CA) 2023-12-07 US disclosed
US-11773108-B2 Indene derivatives useful in treating pain and inflammation TARO PHARMACEUTICALS INC. (CA) 2023-10-03 US disclosed
US-11352367-B2 Indene derivatives useful in treating pain and inflammation TARO PHARMACEUTICALS INC. (CA) 2022-06-07 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-20230391790-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION IL1B, IL1A, LTB4R HTR2A 782/4885HTR2C 978/4885HTR2B 276/4885
US-11352367-B2 Indene derivatives useful in treating pain and inflammation IL1B, IL1A, LTB4R HTR2A 782/4885HTR2C 978/4885HTR2B 276/4885
US-11773108-B2 Indene derivatives useful in treating pain and inflammation IL1B, IL1A, LTB4R HTR2A 773/4885HTR2C 962/4885HTR2B 286/4885

“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.