SCHEMBL9079904

SCHEMBL9079904

CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CC(N)C4(CC4)C3)nc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.64
▸ CYP2C9 P11712 1/20 0.64
▸ ATP6V1B2 P21281 1/20 0.64
▸ TBXA2R P21731 1/20 0.64
▸ EDNRA P25101 1/20 0.64
▸ TARBP2 Q15633 1/20 0.64
▸ EPHA2 P29317 1/20 0.48
▸ FLT4 P35916 1/20 0.48
▸ GSK3B P49841 1/20 0.48
▸ RARB P10826 1/20 0.48
▸ TBXAS1 P24557 1/20 0.48
▸ SLC6A3 Q01959 1/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 5/20 0.46
▸ HSD17B10 Q99714 5/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ HPGD P15428 4/20 0.46
▸ HTT P42858 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ XBP1 P17861 1/20 0.46

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
SCHEMBL9080821 0.91 LMNA (0.52) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8775514 0.90 LMNA (0.51) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10677290 0.86 LMNA (0.71) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8775501 0.85 EPHA2 (0.48) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9079699 0.84 EPHA2 (0.49) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8775460 0.84 DPP4 (0.64) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9142705 0.83 LMNA (0.70) LMNACYP2C9ATP6V1B2TBXA2REDNRA
Esafloxacin SCHEMBL1344407 0.82 LMNA (0.69) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10676603 0.82 LMNA (0.69) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9078399 0.81 KDM4E (0.62) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5508428-A Spiro compound DAIICHI PHAMACEUTICAL CO., LTD. (JP) 1996-04-16 — — US disclosed
US-5286723-A Spiro compound DAIICHI SEIYAKU CO., LTD. 1994-02-15 — — US disclosed
EP-0357047-B1 Spiro compounds DAIICHI SEIYAKU CO (JP) 1993-11-03 — — EP disclosed
EP-0529688-A2 Azaspiro n,m alkanes and diazaspiro n,m -alkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-03-03 — — EP disclosed
EP-0357047-A1 Spiro compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-03-07 — — EP disclosed
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