SCHEMBL6785200

SCHEMBL6785200

COc1cc2c(cc1OC)C(C)(C)CC2

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CYP3A4 P08684 1/20 0.46
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 5/20 0.41
MAOA P21397 4/20 0.39
CHRNA7 P36544 2/20 0.39
MAOB P27338 2/20 0.39
SLC6A4 P31645 1/20 0.39
RXRA P19793 2/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
PARP1 P09874 1/20 0.38
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
EHMT2 Q96KQ7 1/20 0.37

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
SCHEMBL1495945 0.87 HTR2C (0.50) MAPTCYP3A4HTR2AHTR2CHTR2B
SCHEMBL4654263 0.87 RXRA (0.37) MAPTCYP3A4ALDH1A1MAPK1SLC6A4
SCHEMBL1496270 0.87 MAPT (0.38) MAPTCYP3A4ALDH1A1MAPK1KDM4E
SCHEMBL1496061 0.85 CYP3A4 (0.40) MAPTCYP3A4RXRAHTR2AHTR2C
SCHEMBL10324926 0.85 HTR2A (0.41) MAPTCYP3A4HTR2AHTR2CHTR2B
SCHEMBL4235784 0.85 BCHE (0.45) MAPTALDH1A1MAOACHRNA7PARP1
SCHEMBL7295409 0.81 ALDH1A1 (0.49) MAPTCYP3A4ALDH1A1KDM4EGAA
SCHEMBL15348324 0.81 RXRA (0.51) MAPTCYP3A4ALDH1A1MAPK1KDM4E
SCHEMBL22589962 0.80 ESR1 (0.35) CYP3A4ALDH1A1RXRAHTR2AHTR2C
Hydrochloric Acid SCHEMBL11483753 0.80 BCHE (0.36) MAPTCYP3A4KDM4EHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828316-B2 Antiallergens KOWA CO., LTD. (JP) 2004-12-07 US disclosed
US-20020042414-A1 Diamide compound and medicine containing the same KOWA CO., LTD. (JP) 2002-04-11 US disclosed
US-6340682-B1 FOR THERAPY OF ALLERGIC IMMUNOLOGICAL DISEASE IS SELECTED FROM ASTHMA, ALLERGIC RHINITIS, INFLAMMATORY LARGE BOWEL DISEASE OR CONTACT DERMATITIS KOWA CO., LTD. (JP) 2002-01-22 US disclosed
EP-0926138-A1 DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-06-30 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 (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-20020042414-A1 Diamide compound and medicine containing the same HRH4, HRH2, HRH1 MAPT 3453/4885CYP3A4 609/4885ALDH1A1 836/4885

“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.