SCHEMBL7634193 — predicted protein targets

Known targets — ChEMBL curated mechanism

ABL1 ADRA1A ADRA1B ADRA1D ADRA2A ADRA2B ADRA2C ADRB2 AGTR1 BCL2 BCL2A1 BCL2L1 BCL2L10 BCL2L2 BCR BRAF CHRM1 CHRNA10 CHRNA9 DRD1 DRD2 DRD3 DRD4 DRD5 EGFR F2 FLT1 FLT4 GCK GHSR GNRHR GRIN1 GRIN2A GRIN2B GRIN2C GRIN2D GRIN3A GRIN3B HTR1A HTR1B HTR1D HTR2A HTR2C HTR3A IDH2 KDR KIT MAOB MCL1 MTTP P P4HB PDGFRB PIK3CA PIK3CB PIK3CD PIK3CG PIK3R1 PIK3R2 PIK3R3 PIK3R5 PIKFYVE ROCK1 ROCK2 SLC18A2 SLC6A2 SLC6A3 SLC6A4 TACR1 TUBA1A TUBA1B TUBA1C TUBA3C TUBA3E TUBA4A TUBB TUBB1 TUBB2A TUBB2B TUBB3 TUBB4A TUBB4B TUBB6 TUBB8 gyrA gyrB parC parE pol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	MAOB known ✓	P27338	1/20	0.32

▸	SLC6A2 known ✓	P23975	1/20	0.32

▸	EP300	Q09472	1/20	0.36

▸	KAT2B	Q92831	1/20	0.36

▸	KAT8	Q9H7Z6	1/20	0.36

▸	CYP19A1	P11511	1/20	0.35

▸	KEAP1	Q14145	2/20	0.34

▸	CYP2D6	P10635	2/20	0.33

▸	CYP1A2	P05177	1/20	0.33

▸	CYP2C9	P11712	1/20	0.33

▸	CASP1	P29466	1/20	0.33

▸	CASP7	P55210	1/20	0.33

▸	ACHE	P22303	1/20	0.33

▸	HTR6	P50406	2/20	0.33

▸	MEN1	O00255	2/20	0.33

▸	KMT2A	Q03164	2/20	0.33

▸	POLB	P06746	2/20	0.33

▸	HTT	P42858	1/20	0.33

▸	SMN1; SMN2	Q16637	1/20	0.33

▸	SLC2A1	P11166	2/20	0.33

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.

Compound	similarity	top predicted	shared targets
SCHEMBL7633875	0.85	ACHE (0.40)	ACHEKDM4ETRPV1
SCHEMBL21065416	0.71	—	—
Phenanthrene SCHEMBL28164716	0.66	ALDH1A1 (0.60)	KEAP1SLC2A1TSHRMAPTHPGD
Naphthalene SCHEMBL476327	0.64	ALOX12 (0.50)	KEAP1MEN1KMT2ASMN1; SMN2SLC2A1
SCHEMBL11365140	0.63	CES1 (0.48)	KEAP1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL7633997	0.63	HPRT1 (0.32)	—
Sulfuric Acid SCHEMBL391202	0.63	TTR (0.46)	CYP1A2SMN1; SMN2TSHRKDM4EMAPT
Catechol SCHEMBL11778548	0.62	SMN1; SMN2 (0.59)	EP300KAT2BKAT8KEAP1CASP1
Biphenyl SCHEMBL21462355	0.62	ALDH1A1 (0.53)	KEAP1SMN1; SMN2TSHRMAPTCA1
Naphthalene SCHEMBL20496113	0.62	ALOX12 (0.47)	KEAP1MEN1KMT2ASMN1; SMN2SLC2A1

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20020002308-A1	Synthesis of 4-ketocyclopentene and cyclopentadiene compounds	DOW CHEMICAL COMPANY, THE	2002-01-03	—	—	US	disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

Patent	Title	Text reads most about	Predicted target · text-rank
US-20020002308-A1	Synthesis of 4-ketocyclopentene and cyclopentadiene compounds	ADH1C, ADH1A, ADH5	MAOB 1869/4885SLC6A2 4186/4885EP300 1749/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.