SCHEMBL9748147

SCHEMBL9748147

Fc1cccc(Cl)c1Cn1ccnc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.53
CYP11B2 P19099 7/20 0.53
CYP19A1 P11511 3/20 0.53
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
POLB P06746 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
MAPT P10636 1/20 0.51
TBXAS1 P24557 1/20 0.51
QPCT Q16769 1/20 0.51
CYP4Z1 Q86W10 1/20 0.51
QPCTL Q9NXS2 1/20 0.51
HSD17B10 Q99714 1/20 0.50
LMNA P02545 1/20 0.50
CYP2A6 P11509 1/20 0.50
CYP2B6 P20813 1/20 0.50
FNTA P49354 2/20 0.49
FNTB P49356 2/20 0.49

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
SCHEMBL28140257 0.89 CYP11B1 (0.59) CYP11B1CYP11B2CYP19A1ALDH1A1POLB
SCHEMBL19541946 0.84 CYP11B1 (0.51) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL27735896 0.76 TBXAS1 (0.50) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL3980782 0.74 POLB (0.58) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL6965526 0.73 CYP19A1 (0.70) CYP11B1CYP11B2CYP19A1ALDH1A1KMT2A
SCHEMBL15720237 0.73 CYP11B1 (0.65) CYP11B1CYP11B2CYP19A1KMT2APOLB
SCHEMBL13105237 0.73 CYP11B1 (0.72) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL31413085 0.73 KDM4E (0.54) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL11703745 0.73 SMN1; SMN2 (0.57) CYP11B1CYP11B2CYP19A1POLBCYP1A2
SCHEMBL11950647 0.72 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1POLBCYP1A2

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-5100890-A Antidepressants, Fungicides HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-31 US disclosed
EP-0218118-B1 ARYLMETHYL AZOLES AND THEIR SALTS, METHOD FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-18 EP disclosed
US-5023357-A Arylmethylazole preparation processes HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-11 US disclosed
US-4876354-A FUNGICIDES, ANTIDEPRESSANTS HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-24 US disclosed
EP-0218118-A1 Arylmethyl azoles and their salts, method for their preparation, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-04-15 EP disclosed