SCHEMBL3933934

SCHEMBL3933934

c1cn(-c2ccc(N3CCNCC3)cc2)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.59
▸ NCF1 P14598 1/20 0.59
▸ PLD1 Q13393 1/20 0.59
▸ LMNA P02545 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ENPP2 Q13822 1/20 0.53
▸ MKNK1 Q9BUB5 1/20 0.53
▸ MKNK2 Q9HBH9 1/20 0.53
▸ NOTUM Q6P988 1/20 0.53
▸ CYP3A4 P08684 3/20 0.52
▸ ADRB1 P08588 5/20 0.50
▸ HTR3E A5X5Y0 3/20 0.50
▸ HTR3B O95264 3/20 0.50
▸ HTR3A P46098 3/20 0.50
▸ HTR3D Q70Z44 3/20 0.50
▸ HTR3C Q8WXA8 3/20 0.50
▸ SIGMAR1 Q99720 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ TSHR P16473 1/20 0.50

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
SCHEMBL138658 0.82 MAPT (0.56) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL4513714 0.80 LSS (0.56) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL10511405 0.79 HRH4 (0.56) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL11072227 0.79 ENPP2 (0.79) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL2532397 0.79 LMNA (0.78) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL11366419 0.78 LMNA (0.51) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL8536306 0.77 LSS (0.60) ENPP2MKNK1MKNK2CYP3A4SIGMAR1
SCHEMBL21423997 0.77 BPTF (0.54) MAPTCYP3A4CYP2D6
Hydrochloric Acid SCHEMBL28701756 0.77 LMNA (0.75) LMNAMAPTENPP2MKNK1MKNK2
SCHEMBL5570604 0.77 ADRB1 (0.77) ADRB2NCF1PLD1LMNAADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096614-B2 Therapeutically active thiazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2015-08-04 — — US disclosed
US-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2014-10-23 — — US disclosed
US-20090306055-A1 PHENYLAZOLE COMPOUNDS, PRODUCTION PROCESS AND ANTIOXIDANTS NIPPON SODA CO., LTD. (JP) 2009-12-10 — — US disclosed
US-20090306055-A1 PHENYLAZOLE COMPOUNDS, PRODUCTION PROCESS AND ANTIOXIDANTS NIPPON SODA CO., LTD. (JP) 2009-12-10 — — US disclosed
US-20090306055-A1 PHENYLAZOLE COMPOUNDS, PRODUCTION PROCESS AND ANTIOXIDANTS NIPPON SODA CO., LTD. (JP) 2009-12-10 — — US disclosed
US-7553837-B2 Phenylazole compounds production process and antioxidants NIPPON SODA CO., LTD. (JP) 2009-06-30 — — US disclosed
US-7553837-B2 Phenylazole compounds production process and antioxidants NIPPON SODA CO., LTD. (JP) 2009-06-30 — — US disclosed
US-7553837-B2 Phenylazole compounds production process and antioxidants NIPPON SODA CO., LTD. (JP) 2009-06-30 — — US disclosed
US-20060247228-A1 Phenylazole compounds production process and antioxidants NIPPON SODA CO., LTD. (JP) 2006-11-02 — — US disclosed
EP-1650206-A1 PHENYLAZOLE COMPOUNDS, PRODUCTION PROCESS, AND ANTIOXIDANTS NIPPON SODA CO., LTD. (JP) 2006-04-26 — — 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 (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-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives TPMT, IFNG, IRF3 ADRB2 2283/4885NCF1 475/4885PLD1 4631/4885
US-20090306055-A1 PHENYLAZOLE COMPOUNDS, PRODUCTION PROCESS AND ANTIOXIDANTS NOX1, CBR1, AOX1 ADRB2 411/4885NCF1 962/4885PLD1 4366/4885
US-20060247228-A1 Phenylazole compounds production process and antioxidants CBR1, CBR3, NOX3 ADRB2 282/4885NCF1 1162/4885PLD1 4322/4885

“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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