SCHEMBL7434740

SCHEMBL7434740

CCCCc1ccc(C(=O)N2CCC(=O)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AVPR2 P30518 1/20 0.53
▸ OXTR P30559 1/20 0.53
▸ AVPR1A P37288 1/20 0.53
▸ MGLL Q99685 3/20 0.51
▸ HPGD P15428 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ FAAH O00519 1/20 0.50
▸ DRD2 P14416 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ RARB P10826 1/20 0.49
▸ PLK1 P53350 1/20 0.49
▸ PLA2G2A P14555 2/20 0.48
▸ THRB P10828 2/20 0.48
▸ THRA P10827 1/20 0.48
▸ USP2 O75604 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45

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
Ethylene SCHEMBL8376612 0.97 AVPR2 (0.51) AVPR2OXTRAVPR1AMGLLHPGD
Ethylene SCHEMBL8377847 0.88 USP2 (0.51) AVPR2OXTRAVPR1AMGLLHPGD
SCHEMBL11193016 0.82 SIGMAR1 (0.55) AVPR2OXTRAVPR1AMGLLHPGD
Ethylene SCHEMBL8379410 0.82 SLC6A7 (0.51) MGLLHPGDALDH1A1DRD2MEN1
SCHEMBL4376369 0.81 DRD2 (0.66) ALDH1A1DRD2MEN1KMT2APLA2G2A
SCHEMBL7438028 0.81 HPGD (0.76) HPGDALDH1A1DRD2MEN1KMT2A
SCHEMBL18978543 0.81 ALDH1A1 (0.62) AVPR2OXTRAVPR1AHPGDALDH1A1
SCHEMBL24120195 0.80 HPGD (0.61) HPGDALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL12736237 0.79 HSD17B10 (0.63) AVPR2OXTRAVPR1AMGLLHPGD
SCHEMBL7434832 0.79 CNR2 (0.57) HPGDKMT2ASMN1; SMN2

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-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 — — US disclosed
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