SCHEMBL14612757

SCHEMBL14612757

Bc1c(CC)ccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ HPRT1 P00492 1/20 0.41
▸ CYP1A2 P05177 2/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ NCEH1 Q6PIU2 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38

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
SCHEMBL12045260 0.81 HSD17B10 (0.46) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL15948913 0.79 ALDH1A1 (0.44) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL1402654 0.77 CYP2A6 (0.46) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL607363 0.77 TSHR (0.56) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL103056 0.77 NCEH1 (0.50) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL6910872 0.75 CYP2A6 (0.54) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL8850092 0.75 GABRA1 (0.52) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL10836634 0.75 CYP2A6 (0.44) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL10996479 0.75 CYP2A6 (0.44) CYP2A6TSHRALDH1A1HSD17B10TDP1
SCHEMBL1402335 0.75 CYP2A6 (0.44) CYP2A6TSHRALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-15 — — 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 (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-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells CCR3, CCR1, CCR4 CYP2A6 879/4885TSHR 2336/4885ALDH1A1 486/4885

“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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