SCHEMBL9634894

SCHEMBL9634894

CCOCCn1c(CCl)nc2cccnc21

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.53
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 1/20 0.48
TP53 P04637 5/20 0.46
LMNA P02545 3/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.45
KDM4E B2RXH2 1/20 0.43
GAA P10253 2/20 0.40
ENPP2 Q13822 1/20 0.40
TBXA2R P21731 1/20 0.39

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
SCHEMBL14263836 0.89 SLC6A9 (0.55) SLC6A9MEN1KMT2ATSHRTP53
SCHEMBL4772386 0.85 TP53 (0.51) MEN1KMT2ATP53LMNAALDH1A1
SCHEMBL10444904 0.82 SLC6A9 (0.67) SLC6A9MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL9686512 0.81 SLC6A9 (0.68) SLC6A9MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL10444947 0.81 ALDH1A1 (0.51) SLC6A9MEN1KMT2ATSHRTP53
SCHEMBL9685926 0.81 SLC6A9 (0.68) SLC6A9MEN1KMT2ATSHRLMNA
SCHEMBL16768160 0.81 GAA (0.51) MEN1KMT2ATSHRTP53LMNA
SCHEMBL7497251 0.80 MEN1 (0.68) MEN1KMT2ATSHRLMNARAB9A
SCHEMBL9635804 0.79 LMNA (0.47) MEN1KMT2ATP53LMNAKDM4E
SCHEMBL9634452 0.79 CYP1A2 (0.47) SLC6A9MEN1KMT2ATSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0307014-B1 ANTI-ALLERGIC 2-(HETEROCYCLYL ALKYL) IMIDAZO PYRIDINES AND 2-(HETEROCYCLYL ALKYL) PURINES JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-09 EP disclosed
US-5086056-A Treating allergic diseases JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-04 US disclosed
US-5011842-A Antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-04-30 US disclosed
US-4946843-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-08-07 US disclosed