SCHEMBL11064167

SCHEMBL11064167

O=C(c1ccccc1)c1ccc2[nH]c3cc4ccncc4cc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HASPIN Q8TF76 6/20 0.46
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ABL1 P00519 1/20 0.43
FABP6 P51161 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP3A4 P08684 1/20 0.41
CCNT1 O60563 2/20 0.40
CDK9 P50750 2/20 0.40
NPC1 O15118 1/20 0.40
PIM1 P11309 2/20 0.40
ROCK2 O75116 1/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40

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
SCHEMBL22810058 0.78 PIM1 (0.61) HASPINALDH1A1HPGDSMN1; SMN2CCNT1
SCHEMBL1594417 0.78 PIM1 (0.61) HASPINALDH1A1HPGDSMN1; SMN2CCNT1
SCHEMBL29625633 0.78 HASPIN (0.59) HASPINCCNT1CDK9PIM1
SCHEMBL11069044 0.76 ALDH1A1 (0.57) RAB9AALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL11071687 0.76 HASPIN (0.48) HASPINCCNT1CDK9PIM1
SCHEMBL9739332 0.75 ACHE (0.57) HASPINCCNT1CDK9PIM1
SCHEMBL677456 0.74 ALK (0.47) RAB9AALDH1A1POLBHPGDSMN1; SMN2
SCHEMBL29152717 0.71 ATM (0.57) RAB9AALDH1A1POLBHPGDSMN1; SMN2
SCHEMBL11826831 0.71 KIT (0.64) RAB9AALDH1A1POLBHPGDSMN1; SMN2
SCHEMBL24277019 0.70 ACHE (0.73) HASPINRAB9AALDH1A1POLBHPGD

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-4483989-A BENZOYLATION 6-HYDROXYCARBAZOLE, FORMYLATING, CYCLIZATION, AND SAPONIFICATION AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1984-11-20 US claimed